23.24 18.598 34.469 24.672 A O5' DC 1 ATOM A O5' DC 1 1 1.00 1 O 8.00 19.853 34.632 23.883 A C5' DC 1 ATOM A C5' DC 1 1 1.00 1 C 8.78 20.375 33.233 23.597 A C4' DC 1 ATOM A C4' DC 1 1 1.00 1 C 4.39 19.588 32.144 23.890 A O4' DC 1 ATOM A O4' DC 1 1 1.00 1 O 7.95 20.724 33.087 22.103 A C3' DC 1 ATOM A C3' DC 1 1 1.00 1 C 9.69 22.134 32.896 22.052 A O3' DC 1 ATOM A O3' DC 1 1 1.00 1 O 6.58 19.831 31.942 21.627 A C2' DC 1 ATOM A C2' DC 1 1 1.00 1 C 1.06 19.540 31.137 22.796 A C1' DC 1 ATOM A C1' DC 1 1 1.00 1 C 0.29 18.224 30.436 22.936 A N1 DC 1 ATOM A N1 DC 1 1 1.00 1 N 0.00 18.312 29.192 23.521 A C2 DC 1 ATOM A C2 DC 1 1 1.00 1 C 3.13 19.377 28.685 23.820 A O2 DC 1 ATOM A O2 DC 1 1 1.00 1 O 0.88 17.176 28.507 23.712 A N3 DC 1 ATOM A N3 DC 1 1 1.00 1 N 0.48 15.928 28.994 23.419 A C4 DC 1 ATOM A C4 DC 1 1 1.00 1 C 0.00 14.909 28.182 23.705 A N4 DC 1 ATOM A N4 DC 1 1 1.00 1 N 0.82 15.868 30.262 22.879 A C5 DC 1 ATOM A C5 DC 1 1 1.00 1 C 0.00 17.011 30.931 22.644 A C6 DC 1 ATOM A C6 DC 1 1 1.00 1 C 16.46 22.882 32.793 20.648 A P DG 2 ATOM A P DG 1 2 1.00 1 P 19.66 24.263 33.416 20.654 A OP1 DG 2 ATOM A OP1 DG 1 2 1.00 1 O 15.08 22.030 33.499 19.624 A OP2 DG 2 ATOM A OP2 DG 1 2 1.00 1 O 11.47 22.828 31.228 20.393 A O5' DG 2 ATOM A O5' DG 1 2 1.00 1 O 12.48 23.183 30.250 21.391 A C5' DG 2 ATOM A C5' DG 1 2 1.00 1 C 9.02 23.275 28.946 20.609 A C4' DG 2 ATOM A C4' DG 1 2 1.00 1 C 8.75 22.061 28.249 20.845 A O4' DG 2 ATOM A O4' DG 1 2 1.00 1 O 6.66 23.445 28.994 19.090 A C3' DG 2 ATOM A C3' DG 1 2 1.00 1 C 12.59 24.357 27.995 18.651 A O3' DG 2 ATOM A O3' DG 1 2 1.00 1 O 4.95 22.047 28.780 18.562 A C2' DG 2 ATOM A C2' DG 1 2 1.00 1 C 1.69 21.484 27.881 19.630 A C1' DG 2 ATOM A C1' DG 1 2 1.00 1 C 0.00 20.028 27.995 19.745 A N9 DG 2 ATOM A N9 DG 1 2 1.00 1 N 0.00 19.202 29.057 19.465 A C8 DG 2 ATOM A C8 DG 1 2 1.00 1 C 0.00 17.972 28.812 19.643 A N7 DG 2 ATOM A N7 DG 1 2 1.00 1 N 0.00 17.933 27.484 20.094 A C5 DG 2 ATOM A C5 DG 1 2 1.00 1 C 0.00 16.841 26.656 20.495 A C6 DG 2 ATOM A C6 DG 1 2 1.00 1 C 0.00 15.678 26.926 20.476 A O6 DG 2 ATOM A O6 DG 1 2 1.00 1 O 0.00 17.234 25.412 20.895 A N1 DG 2 ATOM A N1 DG 1 2 1.00 1 N 0.90 18.574 25.000 20.857 A C2 DG 2 ATOM A C2 DG 1 2 1.00 1 C 0.00 18.763 23.709 21.226 A N2 DG 2 ATOM A N2 DG 1 2 1.00 1 N 0.00 19.613 25.749 20.533 A N3 DG 2 ATOM A N3 DG 1 2 1.00 1 N 0.00 19.215 26.965 20.152 A C4 DG 2 ATOM A C4 DG 1 2 1.00 1 C 13.81 25.149 27.599 17.342 A P DC 3 ATOM A P DC 1 3 1.00 1 P 10.74 26.588 27.904 17.704 A OP1 DC 3 ATOM A OP1 DC 1 3 1.00 1 O 1.67 24.552 28.451 16.261 A OP2 DC 3 ATOM A OP2 DC 1 3 1.00 1 O 0.28 24.787 26.062 16.967 A O5' DC 3 ATOM A O5' DC 1 3 1.00 1 O 8.45 24.867 24.929 17.736 A C5' DC 3 ATOM A C5' DC 1 3 1.00 1 C 2.36 23.617 24.125 17.711 A C4' DC 3 ATOM A C4' DC 1 3 1.00 1 C 5.43 22.438 24.794 18.086 A O4' DC 3 ATOM A O4' DC 1 3 1.00 1 O 11.82 23.294 23.602 16.299 A C3' DC 3 ATOM A C3' DC 1 3 1.00 1 C 9.10 24.069 22.393 16.026 A O3' DC 3 ATOM A O3' DC 1 3 1.00 1 O 3.92 21.799 23.304 16.382 A C2' DC 3 ATOM A C2' DC 1 3 1.00 1 C 0.00 21.326 23.942 17.596 A C1' DC 3 ATOM A C1' DC 1 3 1.00 1 C 0.00 20.207 24.794 17.215 A N1 DC 3 ATOM A N1 DC 1 3 1.00 1 N 0.68 18.931 24.434 17.558 A C2 DC 3 ATOM A C2 DC 1 3 1.00 1 C 4.99 18.717 23.419 18.187 A O2 DC 3 ATOM A O2 DC 1 3 1.00 1 O 0.00 17.899 25.285 17.240 A N3 DC 3 ATOM A N3 DC 1 3 1.00 1 N 3.09 18.115 26.446 16.611 A C4 DC 3 ATOM A C4 DC 1 3 1.00 1 C 0.11 17.108 27.290 16.312 A N4 DC 3 ATOM A N4 DC 1 3 1.00 1 N 3.95 19.462 26.811 16.242 A C5 DC 3 ATOM A C5 DC 1 3 1.00 1 C 3.17 20.445 25.983 16.554 A C6 DC 3 ATOM A C6 DC 1 3 1.00 1 C 6.01 23.981 21.716 14.596 A P DG 4 ATOM A P DG 1 4 1.00 1 P 20.32 25.377 21.426 14.195 A OP1 DG 4 ATOM A OP1 DG 1 4 1.00 1 O 9.28 23.253 22.659 13.674 A OP2 DG 4 ATOM A OP2 DG 1 4 1.00 1 O 12.36 22.991 20.464 14.818 A O5' DG 4 ATOM A O5' DG 1 4 1.00 1 O 0.00 23.013 19.497 15.854 A C5' DG 4 ATOM A C5' DG 1 4 1.00 1 C 6.13 21.695 18.816 15.981 A C4' DG 4 ATOM A C4' DG 1 4 1.00 1 C 0.00 20.513 19.525 16.179 A O4' DG 4 ATOM A O4' DG 1 4 1.00 1 O 3.17 21.353 17.932 14.704 A C3' DG 4 ATOM A C3' DG 1 4 1.00 1 C 0.00 20.646 16.842 15.193 A O3' DG 4 ATOM A O3' DG 1 4 1.00 1 O 2.97 20.540 18.891 13.877 A C2' DG 4 ATOM A C2' DG 1 4 1.00 1 C 0.00 19.741 19.560 15.009 A C1' DG 4 ATOM A C1' DG 1 4 1.00 1 C 0.00 19.421 20.896 14.519 A N9 DG 4 ATOM A N9 DG 1 4 1.00 1 N 0.00 20.103 21.815 13.782 A C8 DG 4 ATOM A C8 DG 1 4 1.00 1 C 0.00 19.452 22.912 13.585 A N7 DG 4 ATOM A N7 DG 1 4 1.00 1 N 0.00 18.222 22.706 14.163 A C5 DG 4 ATOM A C5 DG 1 4 1.00 1 C 0.95 17.059 23.518 14.278 A C6 DG 4 ATOM A C6 DG 1 4 1.00 1 C 5.42 16.938 24.695 13.795 A O6 DG 4 ATOM A O6 DG 1 4 1.00 1 O 0.00 16.018 22.960 14.983 A N1 DG 4 ATOM A N1 DG 1 4 1.00 1 N 0.00 16.149 21.724 15.543 A C2 DG 4 ATOM A C2 DG 1 4 1.00 1 C 0.46 15.084 21.244 16.204 A N2 DG 4 ATOM A N2 DG 1 4 1.00 1 N 0.00 17.181 20.892 15.479 A N3 DG 4 ATOM A N3 DG 1 4 1.00 1 N 2.17 18.181 21.466 14.755 A C4 DG 4 ATOM A C4 DG 1 4 1.00 1 C 7.55 20.047 15.713 14.291 A P DA 5 ATOM A P DA 1 5 1.00 1 P 14.37 20.156 14.338 14.856 A OP1 DA 5 ATOM A OP1 DA 1 5 1.00 1 O 10.20 20.785 15.872 13.045 A OP2 DA 5 ATOM A OP2 DA 1 5 1.00 1 O 10.75 18.501 16.280 14.284 A O5' DA 5 ATOM A O5' DA 1 5 1.00 1 O 9.60 17.887 16.387 15.594 A C5' DA 5 ATOM A C5' DA 1 5 1.00 1 C 6.17 16.397 16.256 15.556 A C4' DA 5 ATOM A C4' DA 1 5 1.00 1 C 5.26 15.819 17.508 15.136 A O4' DA 5 ATOM A O4' DA 1 5 1.00 1 O 6.94 15.836 15.214 14.621 A C3' DA 5 ATOM A C3' DA 1 5 1.00 1 C 7.93 14.598 14.663 15.022 A O3' DA 5 ATOM A O3' DA 1 5 1.00 1 O 6.24 15.831 16.010 13.273 A C2' DA 5 ATOM A C2' DA 1 5 1.00 1 C 0.41 15.377 17.369 13.725 A C1' DA 5 ATOM A C1' DA 1 5 1.00 1 C 0.00 16.001 18.471 12.962 A N9 DA 5 ATOM A N9 DA 1 5 1.00 1 N 0.00 17.244 18.522 12.371 A C8 DA 5 ATOM A C8 DA 1 5 1.00 1 C 0.00 17.516 19.640 11.830 A N7 DA 5 ATOM A N7 DA 1 5 1.00 1 N 0.10 16.431 20.436 12.091 A C5 DA 5 ATOM A C5 DA 1 5 1.00 1 C 0.00 16.089 21.775 11.748 A C6 DA 5 ATOM A C6 DA 1 5 1.00 1 C 1.87 16.853 22.572 11.048 A N6 DA 5 ATOM A N6 DA 1 5 1.00 1 N 0.00 14.873 22.187 12.186 A N1 DA 5 ATOM A N1 DA 1 5 1.00 1 N 0.00 14.050 21.395 12.854 A C2 DA 5 ATOM A C2 DA 1 5 1.00 1 C 0.00 14.288 20.155 13.210 A N3 DA 5 ATOM A N3 DA 1 5 1.00 1 N 0.00 15.475 19.711 12.784 A C4 DA 5 ATOM A C4 DA 1 5 1.00 1 C 4.64 13.535 13.819 14.132 A P DA 6 ATOM A P DA 1 6 1.00 1 P 10.89 12.528 13.384 15.130 A OP1 DA 6 ATOM A OP1 DA 1 6 1.00 1 O 7.71 14.203 12.766 13.413 A OP2 DA 6 ATOM A OP2 DA 1 6 1.00 1 O 13.07 12.810 14.964 13.242 A O5' DA 6 ATOM A O5' DA 1 6 1.00 1 O 2.46 11.951 15.816 14.062 A C5' DA 6 ATOM A C5' DA 1 6 1.00 1 C 0.77 10.849 16.450 13.235 A C4' DA 6 ATOM A C4' DA 1 6 1.00 1 C 0.40 11.407 17.484 12.498 A O4' DA 6 ATOM A O4' DA 1 6 1.00 1 O 3.83 10.121 15.602 12.212 A C3' DA 6 ATOM A C3' DA 1 6 1.00 1 C 8.17 8.769 15.967 12.161 A O3' DA 6 ATOM A O3' DA 1 6 1.00 1 O 3.45 10.868 15.943 10.902 A C2' DA 6 ATOM A C2' DA 1 6 1.00 1 C 0.00 11.232 17.310 11.099 A C1' DA 6 ATOM A C1' DA 1 6 1.00 1 C 3.73 12.531 17.746 10.559 A N9 DA 6 ATOM A N9 DA 1 6 1.00 1 N 0.00 13.766 17.203 10.419 A C8 DA 6 ATOM A C8 DA 1 6 1.00 1 C 0.00 14.635 17.987 9.866 A N7 DA 6 ATOM A N7 DA 1 6 1.00 1 N 1.08 13.950 19.164 9.637 A C5 DA 6 ATOM A C5 DA 1 6 1.00 1 C 0.00 14.322 20.412 9.046 A C6 DA 6 ATOM A C6 DA 1 6 1.00 1 C 0.00 15.533 20.733 8.588 A N6 DA 6 ATOM A N6 DA 1 6 1.00 1 N 0.00 13.327 21.316 8.970 A N1 DA 6 ATOM A N1 DA 1 6 1.00 1 N 2.98 12.057 21.062 9.440 A C2 DA 6 ATOM A C2 DA 1 6 1.00 1 C 0.00 11.637 19.957 10.006 A N3 DA 6 ATOM A N3 DA 1 6 1.00 1 N 0.08 12.647 19.057 10.076 A C4 DA 6 ATOM A C4 DA 1 6 1.00 1 C 1.53 7.606 15.436 11.214 A P DT 7 ATOM A P DT 1 7 1.00 1 P 8.02 6.439 14.854 12.072 A OP1 DT 7 ATOM A OP1 DT 1 7 1.00 1 O 3.15 8.145 14.319 10.451 A OP2 DT 7 ATOM A OP2 DT 1 7 1.00 1 O 5.18 7.077 16.688 10.457 A O5' DT 7 ATOM A O5' DT 1 7 1.00 1 O 2.59 7.203 18.094 10.781 A C5' DT 7 ATOM A C5' DT 1 7 1.00 1 C 0.14 7.373 18.716 9.402 A C4' DT 7 ATOM A C4' DT 1 7 1.00 1 C 0.00 8.715 18.724 9.071 A O4' DT 7 ATOM A O4' DT 1 7 1.00 1 O 0.00 6.628 18.114 8.201 A C3' DT 7 ATOM A C3' DT 1 7 1.00 1 C 11.81 5.810 19.160 7.660 A O3' DT 7 ATOM A O3' DT 1 7 1.00 1 O 1.18 7.725 17.865 7.183 A C2' DT 7 ATOM A C2' DT 1 7 1.00 1 C 2.49 8.730 18.919 7.597 A C1' DT 7 ATOM A C1' DT 1 7 1.00 1 C 1.91 10.104 18.653 7.209 A N1 DT 7 ATOM A N1 DT 1 7 1.00 1 N 8.72 10.822 19.782 6.732 A C2 DT 7 ATOM A C2 DT 1 7 1.00 1 C 0.61 10.300 20.900 6.560 A O2 DT 7 ATOM A O2 DT 1 7 1.00 1 O 2.81 12.152 19.568 6.363 A N3 DT 7 ATOM A N3 DT 1 7 1.00 1 N 0.00 12.727 18.344 6.522 A C4 DT 7 ATOM A C4 DT 1 7 1.00 1 C 4.45 13.950 18.225 6.198 A O4 DT 7 ATOM A O4 DT 1 7 1.00 1 O 0.00 11.992 17.262 7.063 A C5 DT 7 ATOM A C5 DT 1 7 1.00 1 C 0.00 12.681 15.943 7.228 A C7 DT 7 ATOM A C7 DT 1 7 1.00 1 C 0.00 10.701 17.453 7.380 A C6 DT 7 ATOM A C6 DT 1 7 1.00 1 C 4.24 4.512 19.196 6.732 A P DT 8 ATOM A P DT 1 8 1.00 1 P 8.40 3.405 19.529 7.641 A OP1 DT 8 ATOM A OP1 DT 1 8 1.00 1 O 10.54 4.691 17.912 6.046 A OP2 DT 8 ATOM A OP2 DT 1 8 1.00 1 O 4.41 4.701 20.353 5.658 A O5' DT 8 ATOM A O5' DT 1 8 1.00 1 O 0.00 5.412 21.537 5.848 A C5' DT 8 ATOM A C5' DT 1 8 1.00 1 C 5.60 6.165 21.799 4.596 A C4' DT 8 ATOM A C4' DT 1 8 1.00 1 C 0.00 7.446 21.224 4.660 A O4' DT 8 ATOM A O4' DT 1 8 1.00 1 O 0.00 5.517 21.276 3.274 A C3' DT 8 ATOM A C3' DT 1 8 1.00 1 C 12.82 4.653 22.235 2.784 A O3' DT 8 ATOM A O3' DT 1 8 1.00 1 O 0.13 6.723 21.014 2.435 A C2' DT 8 ATOM A C2' DT 1 8 1.00 1 C 0.00 7.927 21.205 3.248 A C1' DT 8 ATOM A C1' DT 1 8 1.00 1 C 0.41 8.919 20.127 3.159 A N1 DT 8 ATOM A N1 DT 1 8 1.00 1 N 3.05 10.174 20.468 2.721 A C2 DT 8 ATOM A C2 DT 1 8 1.00 1 C 7.82 10.463 21.613 2.352 A O2 DT 8 ATOM A O2 DT 1 8 1.00 1 O 0.00 11.138 19.493 2.670 A N3 DT 8 ATOM A N3 DT 1 8 1.00 1 N 0.00 10.912 18.229 3.070 A C4 DT 8 ATOM A C4 DT 1 8 1.00 1 C 2.32 11.878 17.429 2.950 A O4 DT 8 ATOM A O4 DT 1 8 1.00 1 O 1.61 9.618 17.881 3.541 A C5 DT 8 ATOM A C5 DT 1 8 1.00 1 C 0.00 9.303 16.454 3.948 A C7 DT 8 ATOM A C7 DT 1 8 1.00 1 C 1.93 8.662 18.843 3.560 A C6 DT 8 ATOM A C6 DT 1 8 1.00 1 C 30.76 7.026 17.789 0.210 A BR CBR 9 HETATM A BR CBR 1 9 1.00 1 BR 10.95 4.005 22.841 1.424 A P CBR 9 HETATM A P CBR 1 9 1.00 1 P 13.20 3.257 24.081 1.799 A OP1 CBR 9 HETATM A OP1 CBR 1 9 1.00 1 O 24.39 3.434 21.541 0.947 A OP2 CBR 9 HETATM A OP2 CBR 1 9 1.00 1 O 23.52 5.165 23.174 0.394 A O5' CBR 9 HETATM A O5' CBR 1 9 1.00 1 O 13.10 9.084 20.880 -1.297 A N1 CBR 9 HETATM A N1 CBR 1 9 1.00 1 N 7.56 8.084 19.984 -0.992 A C6 CBR 9 HETATM A C6 CBR 1 9 1.00 1 C 4.96 10.397 20.535 -1.221 A C2 CBR 9 HETATM A C2 CBR 1 9 1.00 1 C 2.55 11.256 21.339 -1.475 A O2 CBR 9 HETATM A O2 CBR 1 9 1.00 1 O 11.08 10.667 19.239 -0.839 A N3 CBR 9 HETATM A N3 CBR 1 9 1.00 1 N 11.08 9.686 18.348 -0.547 A C4 CBR 9 HETATM A C4 CBR 1 9 1.00 1 C 6.34 10.038 17.100 -0.197 A N4 CBR 9 HETATM A N4 CBR 1 9 1.00 1 N 7.97 8.312 18.744 -0.636 A C5 CBR 9 HETATM A C5 CBR 1 9 1.00 1 C 18.67 7.497 22.480 -2.524 A C2' CBR 9 HETATM A C2' CBR 1 9 1.00 1 C 18.30 6.315 23.962 0.648 A C5' CBR 9 HETATM A C5' CBR 1 9 1.00 1 C 20.77 7.286 23.732 -0.496 A C4' CBR 9 HETATM A C4' CBR 1 9 1.00 1 C 15.26 8.186 22.675 -0.286 A O4' CBR 9 HETATM A O4' CBR 1 9 1.00 1 O 15.93 8.694 22.270 -1.615 A C1' CBR 9 HETATM A C1' CBR 1 9 1.00 1 C 18.44 6.640 23.530 -1.875 A C3' CBR 9 HETATM A C3' CBR 1 9 1.00 1 C 21.65 6.589 24.850 -2.479 A O3' CBR 9 HETATM A O3' CBR 1 9 1.00 1 O 22.62 6.587 25.400 -3.929 A P DG 10 ATOM A P DG 1 10 1.00 1 P 30.26 6.084 26.803 -4.100 A OP1 DG 10 ATOM A OP1 DG 1 10 1.00 1 O 22.30 5.633 24.434 -4.666 A OP2 DG 10 ATOM A OP2 DG 1 10 1.00 1 O 28.83 7.982 25.182 -4.641 A O5' DG 10 ATOM A O5' DG 1 10 1.00 1 O 28.10 9.322 25.642 -4.545 A C5' DG 10 ATOM A C5' DG 1 10 1.00 1 C 25.89 10.121 24.881 -5.626 A C4' DG 10 ATOM A C4' DG 1 10 1.00 1 C 18.36 10.412 23.554 -5.187 A O4' DG 10 ATOM A O4' DG 1 10 1.00 1 O 21.47 9.366 24.766 -6.948 A C3' DG 10 ATOM A C3' DG 1 10 1.00 1 C 30.03 10.150 24.798 -8.124 A O3' DG 10 ATOM A O3' DG 1 10 1.00 1 O 15.21 8.662 23.435 -6.700 A C2' DG 10 ATOM A C2' DG 1 10 1.00 1 C 8.62 9.846 22.643 -6.147 A C1' DG 10 ATOM A C1' DG 1 10 1.00 1 C 9.05 9.490 21.371 -5.518 A N9 DG 10 ATOM A N9 DG 1 10 1.00 1 N 3.14 8.257 20.868 -5.168 A C8 DG 10 ATOM A C8 DG 1 10 1.00 1 C 1.53 8.300 19.715 -4.602 A N7 DG 10 ATOM A N7 DG 1 10 1.00 1 N 5.72 9.633 19.382 -4.533 A C5 DG 10 ATOM A C5 DG 1 10 1.00 1 C 6.26 10.307 18.241 -4.024 A C6 DG 10 ATOM A C6 DG 1 10 1.00 1 C 5.15 9.764 17.251 -3.503 A O6 DG 10 ATOM A O6 DG 1 10 1.00 1 O 1.86 11.701 18.261 -4.151 A N1 DG 10 ATOM A N1 DG 1 10 1.00 1 N 2.15 12.319 19.315 -4.730 A C2 DG 10 ATOM A C2 DG 1 10 1.00 1 C 2.64 13.669 19.156 -4.755 A N2 DG 10 ATOM A N2 DG 1 10 1.00 1 N 0.00 11.761 20.432 -5.213 A N3 DG 10 ATOM A N3 DG 1 10 1.00 1 N 9.17 10.422 20.388 -5.105 A C4 DG 10 ATOM A C4 DG 1 10 1.00 1 C 31.17 10.732 26.026 -8.995 A P DC 11 ATOM A P DC 1 11 1.00 1 P 31.75 10.771 27.235 -8.124 A OP1 DC 11 ATOM A OP1 DC 1 11 1.00 1 O 34.32 9.791 26.260 -10.139 A OP2 DC 11 ATOM A OP2 DC 1 11 1.00 1 O 26.25 12.118 25.488 -9.580 A O5' DC 11 ATOM A O5' DC 1 11 1.00 1 O 22.53 13.368 25.773 -8.925 A C5' DC 11 ATOM A C5' DC 1 11 1.00 1 C 17.06 14.222 24.501 -8.944 A C4' DC 11 ATOM A C4' DC 1 11 1.00 1 C 23.27 13.463 23.491 -8.277 A O4' DC 11 ATOM A O4' DC 1 11 1.00 1 O 13.76 14.547 23.915 -10.273 A C3' DC 11 ATOM A C3' DC 1 11 1.00 1 C 16.30 15.703 24.493 -10.947 A O3' DC 11 ATOM A O3' DC 1 11 1.00 1 O 13.52 14.674 22.421 -9.968 A C2' DC 11 ATOM A C2' DC 1 11 1.00 1 C 10.10 13.953 22.148 -8.741 A C1' DC 11 ATOM A C1' DC 1 11 1.00 1 C 10.77 12.744 21.323 -8.709 A N1 DC 11 ATOM A N1 DC 1 11 1.00 1 N 8.27 12.815 20.079 -8.092 A C2 DC 11 ATOM A C2 DC 1 11 1.00 1 C 7.43 13.851 19.644 -7.641 A O2 DC 11 ATOM A O2 DC 1 11 1.00 1 O 9.83 11.667 19.319 -8.010 A N3 DC 11 ATOM A N3 DC 1 11 1.00 1 N 4.31 10.489 19.755 -8.518 A C4 DC 11 ATOM A C4 DC 1 11 1.00 1 C 2.49 9.434 18.982 -8.423 A N4 DC 11 ATOM A N4 DC 1 11 1.00 1 N 10.25 10.419 21.038 -9.148 A C5 DC 11 ATOM A C5 DC 1 11 1.00 1 C 8.83 11.545 21.779 -9.205 A C6 DC 11 ATOM A C6 DC 1 11 1.00 1 C 14.43 15.773 24.105 -12.542 A P DG 12 ATOM A P DG 1 12 1.00 1 P 17.80 16.300 25.139 -13.426 A OP1 DG 12 ATOM A OP1 DG 1 12 1.00 1 O 26.65 14.375 23.843 -12.981 A OP2 DG 12 ATOM A OP2 DG 1 12 1.00 1 O 17.22 16.642 22.774 -12.383 A O5' DG 12 ATOM A O5' DG 1 12 1.00 1 O 0.00 17.875 22.639 -11.633 A C5' DG 12 ATOM A C5' DG 1 12 1.00 1 C 8.26 18.115 21.121 -11.722 A C4' DG 12 ATOM A C4' DG 1 12 1.00 1 C 0.00 17.156 20.448 -10.928 A O4' DG 12 ATOM A O4' DG 1 12 1.00 1 O 4.14 18.037 20.480 -13.102 A C3' DG 12 ATOM A C3' DG 1 12 1.00 1 C 10.39 19.309 20.464 -13.826 A O3' DG 12 ATOM A O3' DG 1 12 1.00 1 O 0.00 17.564 19.073 -12.835 A C2' DG 12 ATOM A C2' DG 1 12 1.00 1 C 1.66 16.819 19.232 -11.544 A C1' DG 12 ATOM A C1' DG 1 12 1.00 1 C 0.88 15.339 19.319 -11.760 A N9 DG 12 ATOM A N9 DG 1 12 1.00 1 N 0.00 14.608 20.329 -12.263 A C8 DG 12 ATOM A C8 DG 1 12 1.00 1 C 0.00 13.361 20.071 -12.333 A N7 DG 12 ATOM A N7 DG 1 12 1.00 1 N 0.91 13.239 18.796 -11.811 A C5 DG 12 ATOM A C5 DG 1 12 1.00 1 C 0.56 12.099 17.944 -11.589 A C6 DG 12 ATOM A C6 DG 1 12 1.00 1 C 0.00 10.917 18.134 -11.767 A O6 DG 12 ATOM A O6 DG 1 12 1.00 1 O 6.23 12.463 16.712 -11.061 A N1 DG 12 ATOM A N1 DG 1 12 1.00 1 N 0.00 13.730 16.347 -10.781 A C2 DG 12 ATOM A C2 DG 1 12 1.00 1 C 1.41 13.812 15.123 -10.267 A N2 DG 12 ATOM A N2 DG 1 12 1.00 1 N 0.00 14.746 17.116 -10.953 A N3 DG 12 ATOM A N3 DG 1 12 1.00 1 N 0.00 14.472 18.308 -11.455 A C4 DG 12 ATOM A C4 DG 1 12 1.00 1 C 17.18 7.303 9.537 -10.082 B O5' DC 13 ATOM B O5' DC 1 1 1.00 1 O 15.40 8.436 8.554 -10.076 B C5' DC 13 ATOM B C5' DC 1 1 1.00 1 C 4.79 9.497 9.212 -9.256 B C4' DC 13 ATOM B C4' DC 1 1 1.00 1 C 7.15 9.948 10.396 -9.847 B O4' DC 13 ATOM B O4' DC 1 1 1.00 1 O 8.60 9.016 9.644 -7.889 B C3' DC 13 ATOM B C3' DC 1 1 1.00 1 C 14.12 10.082 9.513 -7.005 B O3' DC 13 ATOM B O3' DC 1 1 1.00 1 O 9.40 8.650 11.133 -8.086 B C2' DC 13 ATOM B C2' DC 1 1 1.00 1 C 8.02 9.776 11.553 -8.944 B C1' DC 13 ATOM B C1' DC 1 1 1.00 1 C 6.70 9.560 12.766 -9.777 B N1 DC 13 ATOM B N1 DC 1 1 1.00 1 N 4.35 10.703 13.502 -10.044 B C2 DC 13 ATOM B C2 DC 1 1 1.00 1 C 8.91 11.827 13.174 -9.624 B O2 DC 13 ATOM B O2 DC 1 1 1.00 1 O 2.87 10.574 14.608 -10.820 B N3 DC 13 ATOM B N3 DC 1 1 1.00 1 N 4.04 9.385 15.000 -11.315 B C4 DC 13 ATOM B C4 DC 1 1 1.00 1 C 4.34 9.368 16.090 -12.078 B N4 DC 13 ATOM B N4 DC 1 1 1.00 1 N 4.59 8.220 14.232 -11.029 B C5 DC 13 ATOM B C5 DC 1 1 1.00 1 C 0.00 8.346 13.146 -10.298 B C6 DC 13 ATOM B C6 DC 1 1 1.00 1 C 9.45 10.305 8.332 -5.937 B P DG 14 ATOM B P DG 1 2 1.00 1 P 17.88 10.089 7.044 -6.599 B OP1 DG 14 ATOM B OP1 DG 1 2 1.00 1 O 17.17 9.443 8.895 -4.844 B OP2 DG 14 ATOM B OP2 DG 1 2 1.00 1 O 14.72 11.834 8.657 -5.613 B O5' DG 14 ATOM B O5' DG 1 2 1.00 1 O 12.72 12.875 8.344 -6.535 B C5' DG 14 ATOM B C5' DG 1 2 1.00 1 C 13.29 13.810 9.592 -6.452 B C4' DG 14 ATOM B C4' DG 1 2 1.00 1 C 3.54 13.188 10.686 -7.044 B O4' DG 14 ATOM B O4' DG 1 2 1.00 1 O 8.67 14.200 9.921 -5.003 B C3' DG 14 ATOM B C3' DG 1 2 1.00 1 C 13.04 15.562 9.921 -4.736 B O3' DG 14 ATOM B O3' DG 1 2 1.00 1 O 14.95 13.630 11.308 -4.806 B C2' DG 14 ATOM B C2' DG 1 2 1.00 1 C 9.89 13.603 11.838 -6.198 B C1' DG 14 ATOM B C1' DG 1 2 1.00 1 C 8.80 12.567 12.873 -6.262 B N9 DG 14 ATOM B N9 DG 1 2 1.00 1 N 2.04 11.237 12.674 -6.026 B C8 DG 14 ATOM B C8 DG 1 2 1.00 1 C 7.23 10.531 13.748 -6.166 B N7 DG 14 ATOM B N7 DG 1 2 1.00 1 N 6.31 11.475 14.743 -6.522 B C5 DG 14 ATOM B C5 DG 1 2 1.00 1 C 5.17 11.329 16.129 -6.859 B C6 DG 14 ATOM B C6 DG 1 2 1.00 1 C 6.10 10.261 16.751 -6.872 B O6 DG 14 ATOM B O6 DG 1 2 1.00 1 O 0.00 12.489 16.751 -7.190 B N1 DG 14 ATOM B N1 DG 1 2 1.00 1 N 0.00 13.683 16.106 -7.183 B C2 DG 14 ATOM B C2 DG 1 2 1.00 1 C 3.53 14.780 16.819 -7.533 B N2 DG 14 ATOM B N2 DG 1 2 1.00 1 N 5.58 13.856 14.838 -6.923 B N3 DG 14 ATOM B N3 DG 1 2 1.00 1 N 4.23 12.725 14.196 -6.605 B C4 DG 14 ATOM B C4 DG 1 2 1.00 1 C 8.94 16.421 9.806 -3.395 B P DC 15 ATOM B P DC 1 3 1.00 1 P 14.68 17.477 8.764 -3.573 B OP1 DC 15 ATOM B OP1 DC 1 3 1.00 1 O 16.74 15.407 9.449 -2.333 B OP2 DC 15 ATOM B OP2 DC 1 3 1.00 1 O 13.44 17.072 11.236 -3.064 B O5' DC 15 ATOM B O5' DC 1 3 1.00 1 O 10.84 18.164 11.688 -3.871 B C5' DC 15 ATOM B C5' DC 1 3 1.00 1 C 8.32 18.137 13.186 -3.821 B C4' DC 15 ATOM B C4' DC 1 3 1.00 1 C 7.97 16.914 13.633 -4.310 B O4' DC 15 ATOM B O4' DC 1 3 1.00 1 O 8.66 18.275 13.701 -2.397 B C3' DC 15 ATOM B C3' DC 1 3 1.00 1 C 15.18 19.549 14.180 -2.168 B O3' DC 15 ATOM B O3' DC 1 3 1.00 1 O 10.87 17.319 14.869 -2.365 B C2' DC 15 ATOM B C2' DC 1 3 1.00 1 C 4.19 16.542 14.850 -3.623 B C1' DC 15 ATOM B C1' DC 1 3 1.00 1 C 4.74 15.074 14.842 -3.312 B N1 DC 15 ATOM B N1 DC 1 3 1.00 1 N 0.00 14.380 15.971 -3.636 B C2 DC 15 ATOM B C2 DC 1 3 1.00 1 C 3.08 14.938 16.945 -4.138 B O2 DC 15 ATOM B O2 DC 1 3 1.00 1 O 3.43 13.045 15.971 -3.388 B N3 DC 15 ATOM B N3 DC 1 3 1.00 1 N 2.11 12.417 14.905 -2.791 B C4 DC 15 ATOM B C4 DC 1 3 1.00 1 C 3.92 11.091 15.016 -2.600 B N4 DC 15 ATOM B N4 DC 1 3 1.00 1 N 0.00 13.154 13.768 -2.454 B C5 DC 15 ATOM B C5 DC 1 3 1.00 1 C 0.04 14.470 13.768 -2.702 B C6 DC 15 ATOM B C6 DC 1 3 1.00 1 C 15.47 20.520 14.545 -1.017 B P DG 16 ATOM B P DG 1 4 1.00 1 P 22.75 21.777 13.712 -1.201 B OP1 DG 16 ATOM B OP1 DG 1 4 1.00 1 O 18.60 19.821 14.239 0.292 B OP2 DG 16 ATOM B OP2 DG 1 4 1.00 1 O 16.94 20.979 16.086 -1.176 B O5' DG 16 ATOM B O5' DG 1 4 1.00 1 O 13.62 20.846 16.882 -2.365 B C5' DG 16 ATOM B C5' DG 1 4 1.00 1 C 10.73 20.285 18.225 -2.015 B C4' DG 16 ATOM B C4' DG 1 4 1.00 1 C 8.74 18.851 18.194 -2.022 B O4' DG 16 ATOM B O4' DG 1 4 1.00 1 O 19.09 20.697 18.748 -0.655 B C3' DG 16 ATOM B C3' DG 1 4 1.00 1 C 24.00 20.605 20.139 -0.407 B O3' DG 16 ATOM B O3' DG 1 4 1.00 1 O 15.78 19.557 18.174 0.222 B C2' DG 16 ATOM B C2' DG 1 4 1.00 1 C 8.64 18.392 18.594 -0.693 B C1' DG 16 ATOM B C1' DG 1 4 1.00 1 C 10.95 17.169 17.881 -0.324 B N9 DG 16 ATOM B N9 DG 1 4 1.00 1 N 0.00 17.008 16.720 0.381 B C8 DG 16 ATOM B C8 DG 1 4 1.00 1 C 6.26 15.792 16.343 0.496 B N7 DG 16 ATOM B N7 DG 1 4 1.00 1 N 9.59 15.030 17.322 -0.108 B C5 DG 16 ATOM B C5 DG 1 4 1.00 1 C 7.59 13.623 17.464 -0.299 B C6 DG 16 ATOM B C6 DG 1 4 1.00 1 C 10.70 12.742 16.712 0.127 B O6 DG 16 ATOM B O6 DG 1 4 1.00 1 O 4.54 13.232 18.582 -0.979 B N1 DG 16 ATOM B N1 DG 1 4 1.00 1 N 8.14 14.169 19.469 -1.443 B C2 DG 16 ATOM B C2 DG 1 4 1.00 1 C 5.87 13.683 20.575 -2.085 B N2 DG 16 ATOM B N2 DG 1 4 1.00 1 N 5.07 15.496 19.358 -1.316 B N3 DG 16 ATOM B N3 DG 1 4 1.00 1 N 7.45 15.870 18.281 -0.655 B C4 DG 16 ATOM B C4 DG 1 4 1.00 1 C 30.73 21.816 21.106 -0.095 B P DA 17 ATOM B P DA 1 5 1.00 1 P 31.02 23.035 20.971 -0.960 B OP1 DA 17 ATOM B OP1 DA 1 5 1.00 1 O 24.67 22.188 20.741 1.290 B OP2 DA 17 ATOM B OP2 DA 1 5 1.00 1 O 24.58 21.115 22.520 -0.470 B O5' DA 17 ATOM B O5' DA 1 5 1.00 1 O 20.99 20.105 22.587 -1.488 B C5' DA 17 ATOM B C5' DA 1 5 1.00 1 C 17.50 18.965 23.491 -1.119 B C4' DA 17 ATOM B C4' DA 1 5 1.00 1 C 14.23 17.814 22.774 -0.731 B O4' DA 17 ATOM B O4' DA 1 5 1.00 1 O 22.08 19.195 24.537 -0.025 B C3' DA 17 ATOM B C3' DA 1 5 1.00 1 C 27.42 18.637 25.832 -0.375 B O3' DA 17 ATOM B O3' DA 1 5 1.00 1 O 19.73 18.494 23.950 1.189 B C2' DA 17 ATOM B C2' DA 1 5 1.00 1 C 10.93 17.292 23.265 0.559 B C1' DA 17 ATOM B C1' DA 1 5 1.00 1 C 6.02 16.911 22.064 1.322 B N9 DA 17 ATOM B N9 DA 1 5 1.00 1 N 5.42 17.780 21.145 1.913 B C8 DA 17 ATOM B C8 DA 1 5 1.00 1 C 2.66 17.210 20.159 2.441 B N7 DA 17 ATOM B N7 DA 1 5 1.00 1 N 3.03 15.848 20.381 2.174 B C5 DA 17 ATOM B C5 DA 1 5 1.00 1 C 1.94 14.695 19.640 2.530 B C6 DA 17 ATOM B C6 DA 1 5 1.00 1 C 0.00 14.729 18.495 3.223 B N6 DA 17 ATOM B N6 DA 1 5 1.00 1 N 5.07 13.545 20.198 2.111 B N1 DA 17 ATOM B N1 DA 1 5 1.00 1 N 4.34 13.443 21.339 1.411 B C2 DA 17 ATOM B C2 DA 1 5 1.00 1 C 10.54 14.504 22.092 1.043 B N3 DA 17 ATOM B N3 DA 1 5 1.00 1 N 5.89 15.683 21.530 1.488 B C4 DA 17 ATOM B C4 DA 1 5 1.00 1 C 29.02 18.836 27.160 0.540 B P DA 18 ATOM B P DA 1 6 1.00 1 P 32.76 20.115 27.730 0.025 B OP1 DA 18 ATOM B OP1 DA 1 6 1.00 1 O 28.40 18.928 26.815 2.002 B OP2 DA 18 ATOM B OP2 DA 1 6 1.00 1 O 28.09 17.448 27.885 0.254 B O5' DA 18 ATOM B O5' DA 1 6 1.00 1 O 15.06 16.292 27.128 0.006 B C5' DA 18 ATOM B C5' DA 1 6 1.00 1 C 11.24 15.111 27.437 0.833 B C4' DA 18 ATOM B C4' DA 1 6 1.00 1 C 19.08 14.647 26.181 1.392 B O4' DA 18 ATOM B O4' DA 1 6 1.00 1 O 11.70 15.030 28.360 1.996 B C3' DA 18 ATOM B C3' DA 1 6 1.00 1 C 23.33 13.657 28.883 2.111 B O3' DA 18 ATOM B O3' DA 1 6 1.00 1 O 12.43 15.188 27.508 3.217 B C2' DA 18 ATOM B C2' DA 1 6 1.00 1 C 3.74 14.341 26.308 2.753 B C1' DA 18 ATOM B C1' DA 1 6 1.00 1 C 1.51 14.827 25.107 3.376 B N9 DA 18 ATOM B N9 DA 1 6 1.00 1 N 1.17 16.191 24.774 3.573 B C8 DA 18 ATOM B C8 DA 1 6 1.00 1 C 2.52 16.351 23.653 4.183 B N7 DA 18 ATOM B N7 DA 1 6 1.00 1 N 0.00 15.028 23.174 4.380 B C5 DA 18 ATOM B C5 DA 1 6 1.00 1 C 0.00 14.596 22.013 4.990 B C6 DA 18 ATOM B C6 DA 1 6 1.00 1 C 0.00 15.479 21.145 5.454 B N6 DA 18 ATOM B N6 DA 1 6 1.00 1 N 0.00 13.251 21.894 5.060 B N1 DA 18 ATOM B N1 DA 1 6 1.00 1 N 3.03 12.378 22.809 4.539 B C2 DA 18 ATOM B C2 DA 1 6 1.00 1 C 3.70 12.776 23.978 3.935 B N3 DA 18 ATOM B N3 DA 1 6 1.00 1 N 0.00 14.103 24.081 3.897 B C4 DA 18 ATOM B C4 DA 1 6 1.00 1 C 24.37 13.254 30.119 3.045 B P DT 19 ATOM B P DT 1 7 1.00 1 P 15.00 12.725 31.300 2.295 B OP1 DT 19 ATOM B OP1 DT 1 7 1.00 1 O 20.41 14.579 30.301 3.751 B OP2 DT 19 ATOM B OP2 DT 1 7 1.00 1 O 18.24 12.130 29.505 3.999 B O5' DT 19 ATOM B O5' DT 1 7 1.00 1 O 10.29 11.038 28.681 3.623 B C5' DT 19 ATOM B C5' DT 1 7 1.00 1 C 13.40 10.812 27.797 4.850 B C4' DT 19 ATOM B C4' DT 1 7 1.00 1 C 5.35 11.839 26.850 5.060 B O4' DT 19 ATOM B O4' DT 1 7 1.00 1 O 13.36 10.790 28.661 6.147 B C3' DT 19 ATOM B C3' DT 1 7 1.00 1 C 11.81 9.511 28.994 6.452 B O3' DT 19 ATOM B O3' DT 1 7 1.00 1 O 8.74 11.475 27.786 7.164 B C2' DT 19 ATOM B C2' DT 1 7 1.00 1 C 3.98 11.669 26.514 6.471 B C1' DT 19 ATOM B C1' DT 1 7 1.00 1 C 2.52 12.916 25.852 6.878 B N1 DT 19 ATOM B N1 DT 1 7 1.00 1 N 0.00 12.720 24.600 7.457 B C2 DT 19 ATOM B C2 DT 1 7 1.00 1 C 3.27 11.642 24.121 7.622 B O2 DT 19 ATOM B O2 DT 1 7 1.00 1 O 0.85 13.824 23.911 7.838 B N3 DT 19 ATOM B N3 DT 1 7 1.00 1 N 0.00 15.089 24.390 7.660 B C4 DT 19 ATOM B C4 DT 1 7 1.00 1 C 0.23 15.987 23.602 8.048 B O4 DT 19 ATOM B O4 DT 1 7 1.00 1 O 5.14 15.242 25.674 7.094 B C5 DT 19 ATOM B C5 DT 1 7 1.00 1 C 6.44 16.649 26.228 6.872 B C7 DT 19 ATOM B C7 DT 1 7 1.00 1 C 0.19 14.149 26.351 6.700 B C6 DT 19 ATOM B C6 DT 1 7 1.00 1 C 15.30 8.613 29.414 7.635 B P DT 20 ATOM B P DT 1 8 1.00 1 P 13.63 7.254 29.644 6.929 B OP1 DT 20 ATOM B OP1 DT 1 8 1.00 1 O 19.56 9.247 30.729 8.054 B OP2 DT 20 ATOM B OP2 DT 1 8 1.00 1 O 13.33 8.519 28.396 8.804 B O5' DT 20 ATOM B O5' DT 1 8 1.00 1 O 5.15 7.701 27.163 8.696 B C5' DT 20 ATOM B C5' DT 1 8 1.00 1 C 1.33 8.070 26.296 9.860 B C4' DT 20 ATOM B C4' DT 1 8 1.00 1 C 2.05 9.426 25.915 9.726 B O4' DT 20 ATOM B O4' DT 1 8 1.00 1 O 3.68 7.934 26.886 11.284 B C3' DT 20 ATOM B C3' DT 1 8 1.00 1 C 14.19 6.881 26.236 11.945 B O3' DT 20 ATOM B O3' DT 1 8 1.00 1 O 0.00 9.266 26.597 11.989 B C2' DT 20 ATOM B C2' DT 1 8 1.00 1 C 0.00 9.841 25.602 11.106 B C1' DT 20 ATOM B C1' DT 1 8 1.00 1 C 2.42 11.298 25.618 11.074 B N1 DT 20 ATOM B N1 DT 1 8 1.00 1 N 0.00 11.904 24.394 11.328 B C2 DT 20 ATOM B C2 DT 1 8 1.00 1 C 0.00 11.261 23.411 11.589 B O2 DT 20 ATOM B O2 DT 1 8 1.00 1 O 0.00 13.254 24.366 11.265 B N3 DT 20 ATOM B N3 DT 1 8 1.00 1 N 0.00 13.992 25.468 10.940 B C4 DT 20 ATOM B C4 DT 1 8 1.00 1 C 4.25 15.246 25.258 10.959 B O4 DT 20 ATOM B O4 DT 1 8 1.00 1 O 0.00 13.358 26.688 10.654 B C5 DT 20 ATOM B C5 DT 1 8 1.00 1 C 0.00 14.174 27.916 10.336 B C7 DT 20 ATOM B C7 DT 1 8 1.00 1 C 0.00 12.031 26.736 10.712 B C6 DT 20 ATOM B C6 DT 1 8 1.00 1 C 15.86 11.822 28.003 14.252 B BR CBR 21 HETATM B BR CBR 1 9 1.00 1 BR 15.11 6.320 26.434 13.407 B P CBR 21 HETATM B P CBR 1 9 1.00 1 P 20.90 4.859 26.252 13.191 B OP1 CBR 21 HETATM B OP1 CBR 1 9 1.00 1 O 22.94 6.749 27.738 13.985 B OP2 CBR 21 HETATM B OP2 CBR 1 9 1.00 1 O 15.09 7.043 25.365 14.335 B O5' CBR 21 HETATM B O5' CBR 1 9 1.00 1 O 8.05 11.019 24.319 15.473 B N1 CBR 21 HETATM B N1 CBR 1 9 1.00 1 N 3.14 10.863 25.595 15.015 B C6 CBR 21 HETATM B C6 CBR 1 9 1.00 1 C 0.09 12.268 23.705 15.428 B C2 CBR 21 HETATM B C2 CBR 1 9 1.00 1 C 2.64 12.380 22.540 15.791 B O2 CBR 21 HETATM B O2 CBR 1 9 1.00 1 O 0.11 13.334 24.410 14.990 B N3 CBR 21 HETATM B N3 CBR 1 9 1.00 1 N 3.97 13.237 25.686 14.532 B C4 CBR 21 HETATM B C4 CBR 1 9 1.00 1 C 0.00 14.314 26.320 14.049 B N4 CBR 21 HETATM B N4 CBR 1 9 1.00 1 N 7.45 11.943 26.292 14.551 B C5 CBR 21 HETATM B C5 CBR 1 9 1.00 1 C 0.00 8.893 24.045 16.878 B C2' CBR 21 HETATM B C2' CBR 1 9 1.00 1 C 11.62 6.922 23.990 13.941 B C5' CBR 21 HETATM B C5' CBR 1 9 1.00 1 C 7.90 7.749 23.217 14.939 B C4' CBR 21 HETATM B C4' CBR 1 9 1.00 1 C 9.80 9.113 23.404 14.627 B O4' CBR 21 HETATM B O4' CBR 1 9 1.00 1 O 1.59 9.856 23.522 15.924 B C1' CBR 21 HETATM B C1' CBR 1 9 1.00 1 C 0.80 7.533 23.661 16.382 B C3' CBR 21 HETATM B C3' CBR 1 9 1.00 1 C 8.53 6.876 22.516 16.999 B O3' CBR 21 HETATM B O3' CBR 1 9 1.00 1 O 10.09 6.291 22.425 18.480 B P DG 22 ATOM B P DG 1 10 1.00 1 P 10.80 5.242 21.347 18.531 B OP1 DG 22 ATOM B OP1 DG 1 10 1.00 1 O 8.74 6.060 23.899 18.658 B OP2 DG 22 ATOM B OP2 DG 1 10 1.00 1 O 6.92 7.475 21.930 19.497 B O5' DG 22 ATOM B O5' DG 1 10 1.00 1 O 2.08 8.295 20.816 19.020 B C5' DG 22 ATOM B C5' DG 1 10 1.00 1 C 0.49 9.572 20.797 19.764 B C4' DG 22 ATOM B C4' DG 1 10 1.00 1 C 3.80 10.567 21.577 19.103 B O4' DG 22 ATOM B O4' DG 1 10 1.00 1 O 0.68 9.616 21.320 21.169 B C3' DG 22 ATOM B C3' DG 1 10 1.00 1 C 6.16 10.669 20.717 21.938 B O3' DG 22 ATOM B O3' DG 1 10 1.00 1 O 0.00 10.016 22.785 21.016 B C2' DG 22 ATOM B C2' DG 1 10 1.00 1 C 1.67 11.159 22.492 20.050 B C1' DG 22 ATOM B C1' DG 1 10 1.00 1 C 0.00 11.637 23.720 19.427 B N9 DG 22 ATOM B N9 DG 1 10 1.00 1 N 0.00 11.026 24.881 19.128 B C8 DG 22 ATOM B C8 DG 1 10 1.00 1 C 4.35 11.781 25.769 18.601 B N7 DG 22 ATOM B N7 DG 1 10 1.00 1 N 2.03 13.035 25.119 18.524 B C5 DG 22 ATOM B C5 DG 1 10 1.00 1 C 0.81 14.305 25.547 18.035 B C6 DG 22 ATOM B C6 DG 1 10 1.00 1 C 0.00 14.523 26.668 17.545 B O6 DG 22 ATOM B O6 DG 1 10 1.00 1 O 0.00 15.300 24.636 18.200 B N1 DG 22 ATOM B N1 DG 1 10 1.00 1 N 0.00 15.115 23.435 18.740 B C2 DG 22 ATOM B C2 DG 1 10 1.00 1 C 5.08 16.154 22.595 18.823 B N2 DG 22 ATOM B N2 DG 1 10 1.00 1 N 4.97 13.950 22.952 19.224 B N3 DG 22 ATOM B N3 DG 1 10 1.00 1 N 2.36 12.953 23.883 19.058 B C4 DG 22 ATOM B C4 DG 1 10 1.00 1 C 9.52 10.186 19.648 23.050 B P DC 23 ATOM B P DC 1 11 1.00 1 P 13.94 9.128 18.907 22.300 B OP1 DC 23 ATOM B OP1 DC 1 11 1.00 1 O 14.19 9.803 20.476 24.195 B OP2 DC 23 ATOM B OP2 DC 1 11 1.00 1 O 17.14 11.538 18.764 23.197 B O5' DC 23 ATOM B O5' DC 1 11 1.00 1 O 14.78 12.111 18.352 21.906 B C5' DC 23 ATOM B C5' DC 1 11 1.00 1 C 14.26 13.603 18.364 22.059 B C4' DC 23 ATOM B C4' DC 1 11 1.00 1 C 9.74 14.232 19.541 21.671 B O4' DC 23 ATOM B O4' DC 1 11 1.00 1 O 14.68 14.174 18.114 23.476 B C3' DC 23 ATOM B C3' DC 1 11 1.00 1 C 18.12 15.297 17.251 23.260 B O3' DC 23 ATOM B O3' DC 1 11 1.00 1 O 0.18 14.533 19.477 24.029 B C2' DC 23 ATOM B C2' DC 1 11 1.00 1 C 3.78 14.984 20.123 22.758 B C1' DC 23 ATOM B C1' DC 1 11 1.00 1 C 5.21 14.637 21.541 22.637 B N1 DC 23 ATOM B N1 DC 1 11 1.00 1 N 6.76 15.618 22.342 22.078 B C2 DC 23 ATOM B C2 DC 1 11 1.00 1 C 6.72 16.700 21.866 21.792 B O2 DC 23 ATOM B O2 DC 1 11 1.00 1 O 10.02 15.317 23.677 21.932 B N3 DC 23 ATOM B N3 DC 1 11 1.00 1 N 7.10 14.115 24.232 22.250 B C4 DC 23 ATOM B C4 DC 1 11 1.00 1 C 0.00 13.904 25.543 22.033 B N4 DC 23 ATOM B N4 DC 1 11 1.00 1 N 7.82 13.108 23.372 22.777 B C5 DC 23 ATOM B C5 DC 1 11 1.00 1 C 4.87 13.414 22.064 22.930 B C6 DC 23 ATOM B C6 DC 1 11 1.00 1 C 28.28 15.967 16.347 24.405 B P DG 24 ATOM B P DG 1 12 1.00 1 P 27.79 16.200 14.964 23.832 B OP1 DG 24 ATOM B OP1 DG 1 12 1.00 1 O 22.79 15.043 16.312 25.587 B OP2 DG 24 ATOM B OP2 DG 1 12 1.00 1 O 28.58 17.290 17.159 24.722 B O5' DG 24 ATOM B O5' DG 1 12 1.00 1 O 16.71 18.246 17.920 23.998 B C5' DG 24 ATOM B C5' DG 1 12 1.00 1 C 12.60 18.914 18.907 24.951 B C4' DG 24 ATOM B C4' DG 1 12 1.00 1 C 5.80 18.372 20.147 24.710 B O4' DG 24 ATOM B O4' DG 1 12 1.00 1 O 14.53 18.654 18.701 26.432 B C3' DG 24 ATOM B C3' DG 1 12 1.00 1 C 22.51 19.678 17.873 27.024 B O3' DG 24 ATOM B O3' DG 1 12 1.00 1 O 12.59 18.593 20.091 27.036 B C2' DG 24 ATOM B C2' DG 1 12 1.00 1 C 8.49 18.681 20.995 25.860 B C1' DG 24 ATOM B C1' DG 1 12 1.00 1 C 10.33 17.627 22.013 25.822 B N9 DG 24 ATOM B N9 DG 1 12 1.00 1 N 7.57 16.312 21.854 26.191 B C8 DG 24 ATOM B C8 DG 1 12 1.00 1 C 8.17 15.579 22.904 26.013 B N7 DG 24 ATOM B N7 DG 1 12 1.00 1 N 5.92 16.467 23.824 25.441 B C5 DG 24 ATOM B C5 DG 1 12 1.00 1 C 9.51 16.256 25.159 25.040 B C6 DG 24 ATOM B C6 DG 1 12 1.00 1 C 11.38 15.193 25.805 25.110 B O6 DG 24 ATOM B O6 DG 1 12 1.00 1 O 9.55 17.380 25.781 24.551 B N1 DG 24 ATOM B N1 DG 1 12 1.00 1 N 9.22 18.598 25.147 24.436 B C2 DG 24 ATOM B C2 DG 1 12 1.00 1 C 0.67 19.520 25.991 23.890 B N2 DG 24 ATOM B N2 DG 1 12 1.00 1 N 1.61 18.851 23.879 24.780 B N3 DG 24 ATOM B N3 DG 1 12 1.00 1 N 7.73 17.734 23.301 25.301 B C4 DG 24 ATOM B C4 DG 1 12 1.00 1 C 20.27 14.569 30.915 19.077 A MG MG 26 HETATM C MG MG 2 1.00 1 MG 28.86 10.388 19.251 16.217 B C1 NT 25 HETATM D C1 NT 3 1.00 1 C 26.98 11.570 18.812 16.070 B N1 NT 25 HETATM D N1 NT 3 1.00 1 N 29.03 9.754 19.105 17.316 B N2 NT 25 HETATM D N2 NT 3 1.00 1 N 31.99 9.861 19.846 15.231 B N3 NT 25 HETATM D N3 NT 3 1.00 1 N 29.06 10.371 20.123 13.915 B C2 NT 25 HETATM D C2 NT 3 1.00 1 C 27.54 9.147 20.484 13.038 B C3 NT 25 HETATM D C3 NT 3 1.00 1 C 18.33 8.024 19.996 13.248 B O1 NT 25 HETATM D O1 NT 3 1.00 1 O 27.55 9.465 21.339 12.110 B N4 NT 25 HETATM D N4 NT 3 1.00 1 N 29.42 8.485 21.787 11.220 B C4 NT 25 HETATM D C4 NT 3 1.00 1 C 31.20 8.917 22.465 10.114 B C5 NT 25 HETATM D C5 NT 3 1.00 1 C 32.91 7.820 22.805 9.383 B C6 NT 25 HETATM D C6 NT 3 1.00 1 C 31.39 6.732 22.369 10.025 B N5 NT 25 HETATM D N5 NT 3 1.00 1 N 31.13 5.313 22.512 9.624 B C8 NT 25 HETATM D C8 NT 3 1.00 1 C 28.87 7.143 21.728 11.176 B C7 NT 25 HETATM D C7 NT 3 1.00 1 C 33.53 7.701 23.590 8.124 B C9 NT 25 HETATM D C9 NT 3 1.00 1 C 40.41 6.822 24.469 8.042 B O2 NT 25 HETATM D O2 NT 3 1.00 1 O 34.19 8.519 23.388 7.158 B N6 NT 25 HETATM D N6 NT 3 1.00 1 N 35.10 8.436 24.144 5.918 B C10 NT 25 HETATM D C10 NT 3 1.00 1 C 36.86 9.344 23.911 4.876 B C11 NT 25 HETATM D C11 NT 3 1.00 1 C 34.66 8.980 24.790 3.865 B C12 NT 25 HETATM D C12 NT 3 1.00 1 C 32.61 7.888 25.539 4.278 B N7 NT 25 HETATM D N7 NT 3 1.00 1 N 32.87 7.198 26.573 3.547 B C14 NT 25 HETATM D C14 NT 3 1.00 1 C 31.93 7.589 25.131 5.518 B C13 NT 25 HETATM D C13 NT 3 1.00 1 C 32.56 9.623 25.004 2.587 B C15 NT 25 HETATM D C15 NT 3 1.00 1 C 36.71 9.259 25.900 1.863 B O3 NT 25 HETATM D O3 NT 3 1.00 1 O 35.36 10.667 24.212 2.403 B N8 NT 25 HETATM D N8 NT 3 1.00 1 N 38.28 11.582 24.172 1.246 B C16 NT 25 HETATM D C16 NT 3 1.00 1 C 39.05 11.951 25.511 0.737 B C17 NT 25 HETATM D C17 NT 3 1.00 1 C 45.66 12.754 25.408 -0.572 B C18 NT 25 HETATM D C18 NT 3 1.00 1 C 42.63 12.407 26.121 -1.627 B N9 NT 25 HETATM D N9 NT 3 1.00 1 N 43.85 13.773 24.596 -0.566 B N10 NT 25 HETATM D N10 NT 3 1.00 1 N 22.75 14.970 33.396 25.422 A O HOH 27 HETATM E O HOH 4 1.00 1 O 4.44 19.389 21.648 9.802 A O HOH 28 HETATM E O HOH 4 1.00 1 O 16.77 22.605 19.687 10.890 A O HOH 33 HETATM E O HOH 4 1.00 1 O 15.09 19.251 32.219 17.615 A O HOH 34 HETATM E O HOH 4 1.00 1 O 4.87 26.869 19.105 17.119 A O HOH 35 HETATM E O HOH 4 1.00 1 O 27.87 26.901 24.798 14.221 A O HOH 39 HETATM E O HOH 4 1.00 1 O 14.25 20.314 24.814 12.002 A O HOH 44 HETATM E O HOH 4 1.00 1 O 15.73 12.533 32.679 22.834 A O HOH 46 HETATM E O HOH 4 1.00 1 O 14.33 24.054 35.234 22.593 A O HOH 48 HETATM E O HOH 4 1.00 1 O 22.02 1.922 19.834 10.158 A O HOH 52 HETATM E O HOH 4 1.00 1 O 12.85 2.303 19.303 3.109 A O HOH 53 HETATM E O HOH 4 1.00 1 O 37.05 9.157 14.762 0.572 A O HOH 54 HETATM E O HOH 4 1.00 1 O 24.93 16.812 30.694 26.343 A O HOH 59 HETATM E O HOH 4 1.00 1 O 5.80 14.108 29.006 19.986 A O HOH 61 HETATM E O HOH 4 1.00 1 O 17.67 14.404 30.488 7.552 B O HOH 29 HETATM F O HOH 4 1.00 1 O 11.44 8.536 12.777 -2.460 B O HOH 30 HETATM F O HOH 4 1.00 1 O 26.22 7.191 15.535 -6.382 B O HOH 31 HETATM F O HOH 4 1.00 1 O 8.17 4.026 24.053 16.878 B O HOH 32 HETATM F O HOH 4 1.00 1 O 7.67 11.237 30.147 10.858 B O HOH 36 HETATM F O HOH 4 1.00 1 O 16.91 23.056 12.674 -3.910 B O HOH 37 HETATM F O HOH 4 1.00 1 O 27.06 14.538 18.637 26.769 B O HOH 38 HETATM F O HOH 4 1.00 1 O 16.63 7.893 25.923 20.158 B O HOH 40 HETATM F O HOH 4 1.00 1 O 10.69 13.043 23.190 26.947 B O HOH 41 HETATM F O HOH 4 1.00 1 O 21.47 5.759 22.936 22.294 B O HOH 42 HETATM F O HOH 4 1.00 1 O 6.17 10.778 28.851 18.740 B O HOH 43 HETATM F O HOH 4 1.00 1 O 20.23 20.896 27.160 -3.948 B O HOH 45 HETATM F O HOH 4 1.00 1 O 9.75 13.649 20.024 18.785 B O HOH 47 HETATM F O HOH 4 1.00 1 O 29.29 8.677 28.332 17.138 B O HOH 49 HETATM F O HOH 4 1.00 1 O 14.57 4.264 26.656 16.598 B O HOH 50 HETATM F O HOH 4 1.00 1 O 19.55 16.987 28.554 12.091 B O HOH 51 HETATM F O HOH 4 1.00 1 O 24.19 24.867 23.487 -2.734 B O HOH 55 HETATM F O HOH 4 1.00 1 O 26.12 11.356 27.013 22.605 B O HOH 56 HETATM F O HOH 4 1.00 1 O 35.67 19.836 28.594 8.518 B O HOH 57 HETATM F O HOH 4 1.00 1 O 26.63 21.185 29.703 -2.034 B O HOH 58 HETATM F O HOH 4 1.00 1 O 28.43 12.509 31.197 18.772 B O HOH 60 HETATM F O HOH 4 1.00 1 O 40.07 14.278 29.652 17.412 B O HOH 62 HETATM F O HOH 4 1.00 1 O 0.041203 0.000000 0.000000 0.000000 0.025240 0.000000 0.000000 0.000000 0.015731 0.00000 0.00000 0.00000 Goodsell, D.S. Kopka, M.L. Dickerson, R.E. http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 8 90.00 90.00 90.00 24.270 39.620 63.570 C9 H13 Br N3 O7 P 386.093 n 5-BROMO-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE DNA linking C10 H14 N5 O6 P 331.222 y 2'-DEOXYADENOSINE-5'-MONOPHOSPHATE DNA linking C9 H14 N3 O7 P 307.197 y 2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE DNA linking C10 H14 N5 O7 P 347.221 y 2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE DNA linking C10 H15 N2 O8 P 322.208 y THYMIDINE-5'-MONOPHOSPHATE DNA linking H2 O 18.015 WATER non-polymer Mg 2 24.305 MAGNESIUM ION non-polymer C18 H26 N10 O3 430.464 NETROPSIN non-polymer N 1 N BR N 2 N P N 3 N O N 4 N O N 5 N O N 6 N N N 7 N C N 8 N C N 9 N O N 10 N N N 11 N C N 12 N N N 13 N C N 14 N C N 15 N C N 16 R C N 17 N O N 18 R C N 19 S C N 20 N O N 21 N O N 22 N H N 23 N H N 24 N H N 25 N H N 26 N H N 27 N H N 28 N H N 29 N H N 30 N H N 31 N H N 32 N H N 33 N H N 34 N H N 35 N O N 36 N P N 37 N O N 38 N O N 39 N O N 40 N C N 41 R C N 42 N O N 43 S C N 44 N O N 45 N C N 46 R C Y 47 N N Y 48 N C Y 49 N N Y 50 N C Y 51 N C N 52 N N Y 53 N N Y 54 N C Y 55 N N Y 56 N C N 57 N H N 58 N H N 59 N H N 60 N H N 61 N H N 62 N H N 63 N H N 64 N H N 65 N H N 66 N H N 67 N H N 68 N H N 69 N H N 70 N H N 71 N O N 72 N P N 73 N O N 74 N O N 75 N O N 76 N C N 77 R C N 78 N O N 79 S C N 80 N O N 81 N C N 82 R C N 83 N N N 84 N C N 85 N O N 86 N N N 87 N C N 88 N N N 89 N C N 90 N C N 91 N H N 92 N H N 93 N H N 94 N H N 95 N H N 96 N H N 97 N H N 98 N H N 99 N H N 100 N H N 101 N H N 102 N H N 103 N H N 104 N H N 105 N O N 106 N P N 107 N O N 108 N O N 109 N O N 110 N C N 111 R C N 112 N O N 113 S C N 114 N O N 115 N C N 116 R C Y 117 N N Y 118 N C Y 119 N N Y 120 N C N 121 N C N 122 N O N 123 N N N 124 N C N 125 N N N 126 N N Y 127 N C N 128 N H N 129 N H N 130 N H N 131 N H N 132 N H N 133 N H N 134 N H N 135 N H N 136 N H N 137 N H N 138 N H N 139 N H N 140 N H N 141 N H N 142 N O N 143 N P N 144 N O N 145 N O N 146 N O N 147 N C N 148 R C N 149 N O N 150 S C N 151 N O N 152 N C N 153 R C N 154 N N N 155 N C N 156 N O N 157 N N N 158 N C N 159 N O N 160 N C N 161 N C N 162 N C N 163 N H N 164 N H N 165 N H N 166 N H N 167 N H N 168 N H N 169 N H N 170 N H N 171 N H N 172 N H N 173 N H N 174 N H N 175 N H N 176 N H N 177 N H N 178 N O N 179 N H N 180 N H N 181 N MG N 182 N C N 183 N N N 184 N N N 185 N N N 186 N C N 187 N C N 188 N O N 189 N N Y 190 N C Y 191 N C Y 192 N C Y 193 N N N 194 N C Y 195 N C N 196 N C N 197 N O N 198 N N Y 199 N C Y 200 N C Y 201 N C Y 202 N N N 203 N C Y 204 N C N 205 N C N 206 N O N 207 N N N 208 N C N 209 N C N 210 N C N 211 N N N 212 N N N 213 N H N 214 N H N 215 N H N 216 N H N 217 N H N 218 N H N 219 N H N 220 N H N 221 N H N 222 N H N 223 N H N 224 N H N 225 N H N 226 N H N 227 N H N 228 N H N 229 N H N 230 N H N 231 N H N 232 N H N 233 N H N 234 N H N 235 N H N 236 N H N 237 N H N 238 N H N 1 N sing N 2 N doub N 3 N sing N 4 N sing N 5 N sing N 6 N sing N 7 N sing N 8 N sing N 9 N sing N 10 N sing N 11 N doub N 12 N sing N 13 N doub N 14 N sing N 15 N doub N 16 N sing N 17 N sing N 18 N sing N 19 N sing N 20 N sing N 21 N sing N 22 N sing N 23 N sing N 24 N sing N 25 N sing N 26 N sing N 27 N sing N 28 N sing N 29 N sing N 30 N sing N 31 N sing N 32 N sing N 33 N sing N 34 N sing N 35 N sing N 36 N sing N 37 N sing N 38 N doub N 39 N sing N 40 N sing N 41 N sing N 42 N sing N 43 N sing N 44 N sing N 45 N sing N 46 N sing N 47 N sing N 48 N sing N 49 N sing N 50 N sing N 51 N sing N 52 N sing N 53 N sing N 54 N sing N 55 N sing N 56 N sing N 57 N sing N 58 N sing Y 59 N sing Y 60 N sing Y 61 N doub N 62 N sing Y 63 N sing Y 64 N sing Y 65 N doub N 66 N sing Y 67 N doub N 68 N sing N 69 N sing Y 70 N sing Y 71 N doub N 72 N sing Y 73 N sing N 74 N sing N 75 N sing N 76 N doub N 77 N sing N 78 N sing N 79 N sing N 80 N sing N 81 N sing N 82 N sing N 83 N sing N 84 N sing N 85 N sing N 86 N sing N 87 N sing N 88 N sing N 89 N sing N 90 N sing N 91 N sing N 92 N sing N 93 N sing N 94 N sing N 95 N sing N 96 N sing N 97 N sing N 98 N sing N 99 N doub N 100 N sing N 101 N doub N 102 N sing N 103 N sing N 104 N sing N 105 N sing N 106 N doub N 107 N sing N 108 N sing N 109 N sing N 110 N sing N 111 N doub N 112 N sing N 113 N sing N 114 N sing N 115 N sing N 116 N sing N 117 N sing N 118 N sing N 119 N sing N 120 N sing N 121 N sing N 122 N sing N 123 N sing N 124 N sing N 125 N sing N 126 N sing N 127 N sing N 128 N sing N 129 N sing N 130 N sing N 131 N sing Y 132 N sing Y 133 N sing Y 134 N doub N 135 N sing Y 136 N sing N 137 N sing Y 138 N doub N 139 N doub N 140 N sing N 141 N sing N 142 N sing N 143 N sing N 144 N doub N 145 N sing N 146 N sing N 147 N sing N 148 N sing N 149 N sing N 150 N doub N 151 N sing N 152 N sing N 153 N sing N 154 N sing N 155 N sing N 156 N sing N 157 N sing N 158 N sing N 159 N sing N 160 N sing N 161 N sing N 162 N sing N 163 N sing N 164 N sing N 165 N sing N 166 N sing N 167 N sing N 168 N sing N 169 N sing N 170 N sing N 171 N sing N 172 N sing N 173 N doub N 174 N sing N 175 N sing N 176 N sing N 177 N doub N 178 N sing N 179 N sing N 180 N doub N 181 N sing N 182 N sing N 183 N sing N 184 N sing N 185 N sing N 186 N sing N 187 N doub N 188 N sing N 189 N sing N 190 N sing N 191 N sing N 192 N sing N 193 N sing N 194 N sing N 195 N sing N 196 N sing N 197 N sing N 198 N doub N 199 N sing N 200 N sing N 201 N sing Y 202 N sing Y 203 N doub Y 204 N doub N 205 N sing Y 206 N sing N 207 N sing N 208 N sing Y 209 N sing N 210 N sing N 211 N sing N 212 N sing N 213 N sing N 214 N doub N 215 N sing N 216 N sing N 217 N sing Y 218 N sing Y 219 N doub Y 220 N doub N 221 N sing Y 222 N sing N 223 N sing N 224 N sing Y 225 N sing N 226 N sing N 227 N sing N 228 N sing N 229 N sing N 230 N doub N 231 N sing N 232 N sing N 233 N sing N 234 N sing N 235 N sing N 236 N sing N 237 N sing N 238 N sing N 239 N sing N 240 N doub N 241 N sing N 242 N sing N 243 N sing N 244 N sing US Biochemistry BICHAW 0033 0006-2960 34 4983 4993 10.1021/bi00015a009 7711020 Refinement of netropsin bound to DNA: bias and feedback in electron density map interpretation. 1995 UK J.Mol.Biol. JMOBAK 0070 0022-2836 183 553 563 Binding of an Antitumor Drug to DNA. Netropsin and C-G-C-G-A-A-T-T-BrC-G-C-G 1985 10.2210/pdb101d/pdb pdb_0000101d 1.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 1.000000 0.00000 0.00000 0.00000 3742.288 DNA (5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*(CBR)P*GP*CP*G)-3') 2 syn polymer 24.305 MAGNESIUM ION 1 syn non-polymer 430.464 NETROPSIN 1 syn non-polymer 18.015 water 36 nat water no yes (DC)(DG)(DC)(DG)(DA)(DA)(DT)(DT)(CBR)(DG)(DC)(DG) CGCGAATTCGCG A,B polydeoxyribonucleotide n n n n n n n n n n n n 2.00 38.45 2.891 1 19 A 1 B 24 -0.588 A_DC1:DG24_B 1 -17.827 0.147 -0.114 -0.208 -3.485 1 19 A 2 B 23 -3.444 A_DG2:DC23_B 2 -15.195 -0.027 0.219 -0.267 -4.972 1 19 A 3 B 22 -0.364 A_DC3:DG22_B 3 -6.435 0.096 0.286 -0.177 9.060 1 19 A 4 B 21 1.060 A_DG4:CBR21_B 4 -7.744 -0.217 0.018 0.056 6.129 1 20 A 5 B 20 7.183 A_DA5:DT20_B 5 -20.556 0.430 -0.317 -0.075 3.511 1 20 A 6 B 19 1.086 A_DA6:DT19_B 6 -18.034 -0.042 0.219 -0.078 0.306 1 20 A 7 B 18 4.024 A_DT7:DA18_B 7 -20.982 0.297 -0.043 -0.067 -14.255 1 20 A 8 B 17 7.034 A_DT8:DA17_B 8 -21.443 -0.239 0.405 -0.312 -9.615 1 19 A 9 B 16 2.726 A_CBR9:DG16_B 9 -11.260 0.246 -0.171 -0.354 6.362 1 19 A 10 B 15 -0.785 A_DG10:DC15_B 10 -2.898 -0.226 0.029 -0.252 9.834 1 19 A 11 B 14 -2.711 A_DC11:DG14_B 11 -21.915 0.749 -0.044 -0.370 -6.288 1 19 A 12 B 13 -7.468 A_DG12:DC13_B 12 10.370 0.385 -0.668 -0.273 3.577 34.297 A A 1 2 15.156 B B 24 23 3.615 8.830 -0.183 0.304 AA_DC1DG2:DC23DG24_BB 1 -3.280 5.631 33.016 -1.039 -0.268 3.195 42.837 A A 2 3 -13.357 B B 23 22 3.312 -9.673 0.953 0.420 AA_DG2DC3:DG22DC23_BB 2 2.698 -3.726 41.697 1.548 -1.034 3.134 28.476 A A 3 4 4.267 B B 22 21 3.187 2.081 -0.097 0.731 AA_DC3DG4:CBR21DG22_BB 3 6.284 -12.889 27.711 1.019 1.606 3.286 42.793 A A 4 5 7.497 B B 21 20 3.290 5.455 0.072 0.168 AA_DG4DA5:DT20CBR21_BB 4 1.938 -2.663 42.418 -0.320 0.097 3.177 34.135 A A 5 6 10.030 B B 20 19 3.248 5.814 -0.375 -0.181 AA_DA5DA6:DT19DT20_BB 5 -7.525 12.981 32.821 -1.233 -0.556 3.323 33.154 A A 6 7 -2.856 B B 19 18 3.304 -1.629 -0.205 -0.604 AA_DA6DT7:DA18DT19_BB 6 0.855 -1.500 33.104 -0.782 0.504 3.584 36.800 A A 7 8 2.976 B B 18 17 3.581 1.878 0.275 0.044 AA_DT7DT8:DA17DA18_BB 7 0.973 -1.542 36.741 -0.210 -0.290 3.276 41.760 A A 8 9 1.237 B B 17 16 3.269 0.879 0.217 0.648 AA_DT8CBR9:DG16DA17_BB 8 6.578 -9.264 41.253 0.816 0.391 3.204 27.242 A A 9 10 12.155 B B 16 15 3.089 5.641 -0.017 1.216 AA_CBR9DG10:DC15DG16_BB 9 -5.850 12.606 26.024 1.192 -1.404 3.011 47.399 A A 10 11 -13.387 B B 15 14 3.282 -10.675 -0.565 1.027 AA_DG10DC11:DG14DC15_BB 10 -2.375 2.978 46.191 2.121 0.515 3.948 38.792 A A 11 12 -13.358 B B 14 13 4.200 -8.775 0.449 0.791 AA_DC11DG12:DC13DG14_BB 11 5.297 -8.064 37.464 2.551 0.145 chem_comp_atom chem_comp_bond database_2 pdbx_struct_conn_angle struct_conn struct_conn_type struct_site repository Initial release Version format compliance Version format compliance Data collection Database references Derived calculations 1 0 1995-02-27 1 1 2008-05-22 1 2 2011-07-13 1 3 2023-11-22 _database_2.pdbx_DOI _database_2.pdbx_database_accession _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.value _struct_conn.conn_type_id _struct_conn.id _struct_conn.pdbx_dist_value _struct_conn.pdbx_leaving_atom_flag _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_atom_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_atom_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn_type.id _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id BNL Y NDB 1994-12-14 REL MG MAGNESIUM ION NT NETROPSIN HOH water MO3 26 2 MG MG 26 A NT 25 3 NT NT 25 B HOH 27 4 HOH HOH 27 A HOH 28 4 HOH HOH 28 A HOH 33 4 HOH HOH 33 A HOH 34 4 HOH HOH 34 A HOH 35 4 HOH HOH 35 A HOH 39 4 HOH HOH 39 A HOH 44 4 HOH HOH 44 A HOH 46 4 HOH HOH 46 A HOH 48 4 HOH HOH 48 A HOH 52 4 HOH HOH 52 A HOH 53 4 HOH HOH 53 A HOH 54 4 HOH HOH 54 A HOH 59 4 HOH HOH 59 A MO3 26 4 HOH HOH 61 A HOH 29 4 HOH HOH 29 B HOH 30 4 HOH HOH 30 B HOH 31 4 HOH HOH 31 B HOH 32 4 HOH HOH 32 B HOH 36 4 HOH HOH 36 B HOH 37 4 HOH HOH 37 B HOH 38 4 HOH HOH 38 B HOH 40 4 HOH HOH 40 B HOH 41 4 HOH HOH 41 B HOH 42 4 HOH HOH 42 B HOH 43 4 HOH HOH 43 B HOH 45 4 HOH HOH 45 B HOH 47 4 HOH HOH 47 B HOH 49 4 HOH HOH 49 B HOH 50 4 HOH HOH 50 B HOH 51 4 HOH HOH 51 B HOH 55 4 HOH HOH 55 B HOH 56 4 HOH HOH 56 B HOH 57 4 HOH HOH 57 B HOH 58 4 HOH HOH 58 B MO3 26 4 HOH HOH 60 B MO3 26 4 HOH HOH 62 B C 1 n 1 DC 1 A G 2 n 2 DG 2 A C 3 n 3 DC 3 A G 4 n 4 DG 4 A A 5 n 5 DA 5 A A 6 n 6 DA 6 A T 7 n 7 DT 7 A T 8 n 8 DT 8 A C 9 n 9 CBR 9 A G 10 n 10 DG 10 A C 11 n 11 DC 11 A G 12 n 12 DG 12 A C 13 n 1 DC 13 B G 14 n 2 DG 14 B C 15 n 3 DC 15 B G 16 n 4 DG 16 B A 17 n 5 DA 17 B A 18 n 6 DA 18 B T 19 n 7 DT 19 B T 20 n 8 DT 20 B C 21 n 9 CBR 21 B G 22 n 10 DG 22 B C 23 n 11 DC 23 B G 24 n 12 DG 24 B author_defined_assembly 2 dimeric A HOH 61 E O HOH 1_555 A MG 26 C MG MG 1_555 B HOH 60 F O HOH 1_555 88.3 A HOH 61 E O HOH 1_555 A MG 26 C MG MG 1_555 B HOH 62 F O HOH 1_555 76.9 B HOH 60 F O HOH 1_555 A MG 26 C MG MG 1_555 B HOH 62 F O HOH 1_555 80.2 A CBR 9 A CBR 9 DC B CBR 21 B CBR 9 DC 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 1_555 x,y,z identity operation 0.0000000000 0.0000000000 0.0000000000 1 9.68 1.10 109.80 119.48 A A A C5' C4' O4' DC DC DC 1 1 1 N 1 4.12 0.50 119.90 124.02 A A A C2 N3 C4 DC DC DC 1 1 1 N 1 -5.18 0.40 121.90 116.72 A A A N3 C4 C5 DC DC DC 1 1 1 N 1 7.40 0.70 120.20 127.60 A A A C5 C4 N4 DC DC DC 1 1 1 N 1 -10.62 1.50 119.60 108.98 A A A OP1 P OP2 DG DG DG 2 2 2 N 1 -5.50 0.80 109.40 103.90 A A A O5' C5' C4' DG DG DG 2 2 2 N 1 19.16 1.20 119.70 138.86 A A A C3' O3' P DG DG DC 2 2 3 Y 1 -2.55 0.40 121.90 119.35 A A A N3 C4 C5 DC DC DC 3 3 3 N 1 12.25 1.10 109.80 122.05 A A A C5' C4' O4' DG DG DG 4 4 4 N 1 6.79 0.30 108.30 115.09 A A A O4' C1' N9 DG DG DG 4 4 4 N 1 -4.73 0.60 125.10 120.37 A A A C6 N1 C2 DG DG DG 4 4 4 N 1 4.66 0.60 123.90 128.56 A A A N1 C2 N3 DG DG DG 4 4 4 N 1 3.87 0.50 111.50 115.37 A A A C5 C6 N1 DG DG DG 4 4 4 N 1 -5.28 0.70 119.90 114.62 A A A N3 C2 N2 DG DG DG 4 4 4 N 1 -3.69 0.60 128.60 124.91 A A A C5 C6 O6 DG DG DG 4 4 4 N 1 4.00 0.60 118.60 122.60 A A A C6 N1 C2 DA DA DA 5 5 5 N 1 -3.15 0.50 129.30 126.15 A A A N1 C2 N3 DA DA DA 5 5 5 N 1 8.68 1.20 119.70 128.38 A A A C3' O3' P DA DA DA 5 5 6 Y 1 -5.52 0.70 108.00 102.48 A A A O4' C1' N9 DA DA DA 6 6 6 N 1 3.96 0.60 118.60 122.56 A A A C6 N1 C2 DA DA DA 6 6 6 N 1 -3.05 0.50 117.70 114.65 A A A C5 C6 N1 DA DA DA 6 6 6 N 1 10.09 1.20 119.70 129.79 A A A C3' O3' P DA DA DT 6 6 7 Y 1 -13.42 1.50 119.60 106.18 A A A OP1 P OP2 DT DT DT 7 7 7 N 1 8.52 1.20 110.70 119.22 A A A O5' P OP2 DT DT DT 7 7 7 N 1 -7.65 0.80 109.40 101.75 A A A O5' C5' C4' DT DT DT 7 7 7 N 1 -5.93 0.80 105.90 99.97 A A A O4' C1' C2' DT DT DT 7 7 7 N 1 -6.60 0.60 127.20 120.60 A A A C2 N3 C4 DT DT DT 7 7 7 N 1 5.63 0.60 115.20 120.83 A A A N3 C4 C5 DT DT DT 7 7 7 N 1 14.71 1.20 119.70 134.41 A A A C3' O3' P DT DT DT 7 7 8 Y 1 3.94 0.60 114.60 118.54 A A A N1 C2 N3 DT DT DT 8 8 8 N 1 -4.60 0.60 127.20 122.60 A A A C2 N3 C4 DT DT DT 8 8 8 N 1 3.62 0.60 115.20 118.82 A A A N3 C4 C5 DT DT DT 8 8 8 N 1 -3.82 0.60 119.90 116.08 A A A N3 C4 O4 DT DT DT 8 8 8 N 1 24.02 1.20 119.70 143.72 A A A C3' O3' P DT DT CBR 8 8 9 Y 1 15.63 1.20 119.70 135.33 A A A C3' O3' P CBR CBR DG 9 9 10 Y 1 -10.73 1.50 119.60 108.87 A A A OP1 P OP2 DG DG DG 10 10 10 N 1 18.33 1.60 120.90 139.23 A A A P O5' C5' DG DG DG 10 10 10 N 1 2.75 0.30 108.30 111.05 A A A O4' C1' N9 DG DG DG 10 10 10 N 1 -4.76 0.60 125.10 120.34 A A A C6 N1 C2 DG DG DG 10 10 10 N 1 4.01 0.60 123.90 127.91 A A A N1 C2 N3 DG DG DG 10 10 10 N 1 3.89 0.50 111.50 115.39 A A A C5 C6 N1 DG DG DG 10 10 10 N 1 12.06 1.20 119.70 131.76 A A A C3' O3' P DG DG DC 10 10 11 Y 1 -9.99 1.50 119.60 109.61 A A A OP1 P OP2 DC DC DC 11 11 11 N 1 -4.85 0.70 108.00 103.15 A A A O4' C1' N1 DC DC DC 11 11 11 N 1 -13.02 1.50 119.60 106.58 A A A OP1 P OP2 DG DG DG 12 12 12 N 1 -8.18 0.80 109.40 101.22 A A A O5' C5' C4' DG DG DG 12 12 12 N 1 3.71 0.50 106.80 110.51 A A A O4' C1' C2' DG DG DG 12 12 12 N 1 3.33 0.50 111.90 115.23 A A A C2 N3 C4 DG DG DG 12 12 12 N 1 -4.92 0.80 109.40 104.48 B B B O5' C5' C4' DC DC DC 13 13 13 N 1 -2.46 0.40 121.90 119.44 B B B N3 C4 C5 DC DC DC 13 13 13 N 1 3.81 0.60 118.90 122.71 B B B N1 C2 O2 DC DC DC 13 13 13 N 1 -6.26 0.80 109.40 103.14 B B B O5' C5' C4' DG DG DG 14 14 14 N 1 4.28 0.60 106.00 110.28 B B B O4' C4' C3' DG DG DG 14 14 14 N 1 -6.08 1.00 110.10 104.02 B B B C1' O4' C4' DG DG DG 14 14 14 N 1 13.89 1.20 119.70 133.59 B B B C3' O3' P DG DG DC 14 14 15 Y 1 1.92 0.30 108.30 110.22 B B B O4' C1' N1 DC DC DC 15 15 15 N 1 21.88 1.20 119.70 141.58 B B B C3' O3' P DC DC DG 15 15 16 Y 1 -5.55 0.80 102.40 96.85 B B B C3' C2' C1' DG DG DG 16 16 16 N 1 2.70 0.30 108.30 111.00 B B B O4' C1' N9 DG DG DG 16 16 16 N 1 -4.94 0.60 125.10 120.16 B B B C6 N1 C2 DG DG DG 16 16 16 N 1 3.99 0.50 111.50 115.49 B B B C5 C6 N1 DG DG DG 16 16 16 N 1 -11.36 1.50 119.60 108.24 B B B OP1 P OP2 DA DA DA 17 17 17 N 1 11.98 1.20 110.70 122.68 B B B O5' P OP2 DA DA DA 17 17 17 N 1 6.85 0.60 118.60 125.45 B B B C6 N1 C2 DA DA DA 17 17 17 N 1 -5.55 0.50 129.30 123.75 B B B N1 C2 N3 DA DA DA 17 17 17 N 1 -4.08 0.50 117.70 113.62 B B B C5 C6 N1 DA DA DA 17 17 17 N 1 3.93 0.60 118.60 122.53 B B B N1 C6 N6 DA DA DA 17 17 17 N 1 10.06 1.20 110.70 120.76 B B B O5' P OP1 DA DA DA 18 18 18 N 1 12.06 1.20 115.70 127.76 B B B C5' C4' C3' DA DA DA 18 18 18 N 1 5.20 0.60 118.60 123.80 B B B C6 N1 C2 DA DA DA 18 18 18 N 1 -5.83 0.50 129.30 123.47 B B B N1 C2 N3 DA DA DA 18 18 18 N 1 -3.61 0.50 117.70 114.09 B B B C5 C6 N1 DA DA DA 18 18 18 N 1 7.44 0.60 118.60 126.04 B B B N1 C6 N6 DA DA DA 18 18 18 N 1 -5.70 0.80 109.40 103.70 B B B O5' C5' C4' DT DT DT 19 19 19 N 1 -7.79 1.00 110.10 102.31 B B B C1' O4' C4' DT DT DT 19 19 19 N 1 -4.53 0.60 127.20 122.67 B B B C2 N3 C4 DT DT DT 19 19 19 N 1 -6.18 0.60 119.90 113.72 B B B N3 C4 O4 DT DT DT 19 19 19 N 1 22.28 1.20 119.70 141.98 B B B C3' O3' P DT DT DT 19 19 20 Y 1 11.71 1.90 104.00 115.71 B B B O3' P O5' DT DT DT 19 20 20 Y 1 -6.32 1.00 110.10 103.78 B B B C1' O4' C4' DT DT DT 20 20 20 N 1 -4.92 0.60 127.20 122.28 B B B C2 N3 C4 DT DT DT 20 20 20 N 1 5.17 0.60 115.20 120.37 B B B N3 C4 C5 DT DT DT 20 20 20 N 1 -6.56 0.60 119.90 113.34 B B B N3 C4 O4 DT DT DT 20 20 20 N 1 10.47 1.20 119.70 130.17 B B B C3' O3' P DT DT CBR 20 20 21 Y 1 7.41 1.20 119.70 127.11 B B B C3' O3' P CBR CBR DG 21 21 22 Y 1 -8.07 0.80 102.40 94.33 B B B C3' C2' C1' DG DG DG 22 22 22 N 1 4.53 0.30 108.30 112.83 B B B O4' C1' N9 DG DG DG 22 22 22 N 1 -4.89 0.70 119.90 115.01 B B B N3 C2 N2 DG DG DG 22 22 22 N 1 -4.41 0.60 128.60 124.19 B B B C5 C6 O6 DG DG DG 22 22 22 N 1 -6.20 0.70 108.00 101.80 B B B O4' C1' N1 DC DC DC 23 23 23 N 1 4.41 0.50 119.90 124.31 B B B C2 N3 C4 DC DC DC 23 23 23 N 1 -4.25 0.40 121.90 117.65 B B B N3 C4 C5 DC DC DC 23 23 23 N 1 16.38 1.60 120.90 137.28 B B B P O5' C5' DG DG DG 24 24 24 N 1 -4.68 0.70 108.00 103.32 B B B O4' C1' N9 DG DG DG 24 24 24 N 1 -5.94 0.90 116.20 110.26 B B B N1 C2 N2 DG DG DG 24 24 24 N 1 4.26 0.70 119.90 124.16 B B B N3 C2 N2 DG DG DG 24 24 24 N 1 A A C2' C1' DC DC 1 1 -0.069 0.010 1.518 1.449 N 1 A A O4' C1' DC DC 1 1 0.068 0.011 1.420 1.488 N 1 A A O4' C4' DC DC 1 1 -0.071 0.010 1.446 1.375 N 1 A A N7 C8 DG DG 2 2 -0.038 0.006 1.305 1.267 N 1 A A C2' C1' DC DC 3 3 -0.067 0.010 1.518 1.451 N 1 A A C4' C3' DG DG 4 4 0.061 0.010 1.529 1.590 N 1 A A C2' C1' DA DA 6 6 -0.090 0.010 1.518 1.428 N 1 A A O4' C1' DT DT 7 7 0.067 0.011 1.420 1.487 N 1 A A O4' C4' DT DT 7 7 -0.064 0.010 1.446 1.382 N 1 A A O4' C1' DT DT 8 8 0.072 0.011 1.420 1.492 N 1 A A O3' C3' DT DT 8 8 -0.038 0.006 1.419 1.381 N 1 A A C2' C1' DC DC 11 11 -0.069 0.010 1.518 1.449 N 1 A A O4' C1' DC DC 11 11 0.083 0.011 1.420 1.503 N 1 B B C5' C4' DG DG 14 14 0.050 0.007 1.512 1.562 N 1 B B O4' C1' DG DG 14 14 0.068 0.011 1.420 1.488 N 1 B B O3' C3' DC DC 15 15 -0.039 0.006 1.419 1.380 N 1 B B N7 C8 DA DA 17 17 -0.056 0.007 1.311 1.255 N 1 B B O3' C3' DT DT 19 19 -0.063 0.006 1.419 1.356 N 1 B B C2' C1' DT DT 20 20 -0.069 0.010 1.518 1.449 N 1 B B O4' C4' DG DG 24 24 -0.071 0.010 1.446 1.375 N 0.252 0.163 2.250 8.000 2430 1 2.000 TR isotropic TR isotropic 2.250 8.000 33 556 37 486 0 4.282 6.000 4.990 6.000 5.693 6.000 5.227 6.000 0.024 0.030 0.040 0.040 0.026 0.040 0.057 0.050 0.014 0.020 0.161 0.150 0.093 0.100 0.097 0.100 fix fix refinement NUCLSQ REFINEMENT OF NETROPSIN BOUND TO DNA: BIAS AND FEEDBACK IN ELECTRON DENSITY MAP INTERPRETATION 1 N N 1 N N 2 N N 3 N N 4 N N 4 N N covale 1.624 both A DT 8 A O3' DT 8 1_555 A CBR 9 A P CBR 9 1_555 covale 1.551 both A CBR 9 A O3' CBR 9 1_555 A DG 10 A P DG 10 1_555 covale 1.578 both B DT 20 B O3' DT 8 1_555 B CBR 21 B P CBR 9 1_555 covale 1.595 both B CBR 21 B O3' CBR 9 1_555 B DG 22 B P DG 10 1_555 metalc 2.164 A MG 26 C MG MG 1_555 A HOH 61 E O HOH 1_555 metalc 2.101 A MG 26 C MG MG 1_555 B HOH 60 F O HOH 1_555 metalc 2.110 A MG 26 C MG MG 1_555 B HOH 62 F O HOH 1_555 hydrog WATSON-CRICK A DC 1 A N3 DC 1 1_555 B DG 24 B N1 DG 12 1_555 hydrog WATSON-CRICK A DC 1 A N4 DC 1 1_555 B DG 24 B O6 DG 12 1_555 hydrog WATSON-CRICK A DC 1 A O2 DC 1 1_555 B DG 24 B N2 DG 12 1_555 hydrog WATSON-CRICK A DG 2 A N1 DG 2 1_555 B DC 23 B N3 DC 11 1_555 hydrog WATSON-CRICK A DG 2 A N2 DG 2 1_555 B DC 23 B O2 DC 11 1_555 hydrog WATSON-CRICK A DG 2 A O6 DG 2 1_555 B DC 23 B N4 DC 11 1_555 hydrog WATSON-CRICK A DC 3 A N3 DC 3 1_555 B DG 22 B N1 DG 10 1_555 hydrog WATSON-CRICK A DC 3 A N4 DC 3 1_555 B DG 22 B O6 DG 10 1_555 hydrog WATSON-CRICK A DC 3 A O2 DC 3 1_555 B DG 22 B N2 DG 10 1_555 hydrog WATSON-CRICK A DG 4 A N1 DG 4 1_555 B CBR 21 B N3 CBR 9 1_555 hydrog WATSON-CRICK A DG 4 A N2 DG 4 1_555 B CBR 21 B O2 CBR 9 1_555 hydrog WATSON-CRICK A DG 4 A O6 DG 4 1_555 B CBR 21 B N4 CBR 9 1_555 hydrog WATSON-CRICK A DA 5 A N1 DA 5 1_555 B DT 20 B N3 DT 8 1_555 hydrog WATSON-CRICK A DA 5 A N6 DA 5 1_555 B DT 20 B O4 DT 8 1_555 hydrog WATSON-CRICK A DA 6 A N1 DA 6 1_555 B DT 19 B N3 DT 7 1_555 hydrog WATSON-CRICK A DA 6 A N6 DA 6 1_555 B DT 19 B O4 DT 7 1_555 hydrog WATSON-CRICK A DT 7 A N3 DT 7 1_555 B DA 18 B N1 DA 6 1_555 hydrog WATSON-CRICK A DT 7 A O4 DT 7 1_555 B DA 18 B N6 DA 6 1_555 hydrog WATSON-CRICK A DT 8 A N3 DT 8 1_555 B DA 17 B N1 DA 5 1_555 hydrog WATSON-CRICK A DT 8 A O4 DT 8 1_555 B DA 17 B N6 DA 5 1_555 hydrog WATSON-CRICK A CBR 9 A N3 CBR 9 1_555 B DG 16 B N1 DG 4 1_555 hydrog WATSON-CRICK A CBR 9 A N4 CBR 9 1_555 B DG 16 B O6 DG 4 1_555 hydrog WATSON-CRICK A CBR 9 A O2 CBR 9 1_555 B DG 16 B N2 DG 4 1_555 hydrog WATSON-CRICK A DG 10 A N1 DG 10 1_555 B DC 15 B N3 DC 3 1_555 hydrog WATSON-CRICK A DG 10 A N2 DG 10 1_555 B DC 15 B O2 DC 3 1_555 hydrog WATSON-CRICK A DG 10 A O6 DG 10 1_555 B DC 15 B N4 DC 3 1_555 hydrog WATSON-CRICK A DC 11 A N3 DC 11 1_555 B DG 14 B N1 DG 2 1_555 hydrog WATSON-CRICK A DC 11 A N4 DC 11 1_555 B DG 14 B O6 DG 2 1_555 hydrog WATSON-CRICK A DC 11 A O2 DC 11 1_555 B DG 14 B N2 DG 2 1_555 hydrog WATSON-CRICK A DG 12 A N1 DG 12 1_555 B DC 13 B N3 DC 1 1_555 hydrog WATSON-CRICK A DG 12 A N2 DG 12 1_555 B DC 13 B O2 DC 1 1_555 hydrog WATSON-CRICK A DG 12 A O6 DG 12 1_555 B DC 13 B N4 DC 1 1_555 DNA B-DNA, DOUBLE HELIX, COMPLEXED WITH DRUG, MODIFIED, DNA 101D PDB 1 101D 1 12 101D 1 12 101D A 1 1 12 13 24 101D 13 24 101D B 1 1 12 BINDING SITE FOR RESIDUE NT B 25 B NT 25 Software 9 BINDING SITE FOR RESIDUE MG A 26 A MG 26 Software 3 A DA 6 A DA 6 9 1_555 A DT 7 A DT 7 9 1_555 A DT 8 A DT 8 9 1_555 B DA 17 B DA 5 9 1_555 B DA 18 B DA 6 9 1_555 B DT 19 B DT 7 9 1_555 B DT 20 B DT 8 9 1_555 B CBR 21 B CBR 9 9 1_555 B DG 22 B DG 10 9 1_555 A HOH 61 E HOH 3 1_555 B HOH 60 F HOH 3 1_555 B HOH 62 F HOH 3 1_555 19 P 21 21 21