Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 49X

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 115


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 R N N 0 1.232 3.343 0.787
2 CBB C C2 N N N 0 -19.61 -1.392 0.715
3 CBA C C3 N N N 0 -18.378 -1.575 -0.175
4 CAZ C C4 N N N 0 -17.115 -1.273 0.634
5 CAY C C5 N N N 0 -15.884 -1.455 -0.256
6 CAX C C6 N N N 0 -14.621 -1.153 0.553
7 CAW C C7 N N N 0 -13.389 -1.335 -0.336
8 CAV C C8 N N N 0 -12.127 -1.033 0.473
9 CAU C C9 N N N 0 -10.895 -1.216 -0.417
10 CAT C C10 N N N 0 -9.632 -0.914 0.392
11 CAS C C11 N N N 0 -8.401 -1.096 -0.498
12 CAR C C12 N N N 0 -7.138 -0.794 0.311
13 CAQ C C13 N N N 0 -5.907 -0.976 -0.578
14 CAP C C14 N N N 0 -4.644 -0.674 0.231
15 CAO C C15 N N N 0 -3.412 -0.857 -0.659
16 CAN C C16 R N N 0 -2.149 -0.555 0.15
17 OBN O O1 N N N 0 -2.009 -1.522 1.193
18 CAM C C17 S N N 0 -0.928 -0.615 -0.769
19 OBL O O2 N N N 0 -1.068 0.352 -1.812
20 CAL C C18 S N N 0 0.335 -0.313 0.04
21 CAK C C19 N N N 0 0.283 1.107 0.54
22 CAH C C20 N N N 0 1.215 1.959 0.191
23 OG O O3 N N N 0 2.407 3.505 1.584
24 CG C C21 R N N 0 3.629 3.318 0.866
25 CG5 C C22 N N N 0 4.812 3.487 1.821
26 OG6 O O4 N N N 0 4.786 2.447 2.8
27 CG4 C C23 R N N 0 3.725 4.357 -0.255
28 OG5 O O5 N N N 0 3.754 5.668 0.311
29 CG3 C C24 R N N 0 2.506 4.221 -1.172
30 OG4 O O6 N N N 0 2.549 5.234 -2.179
31 CG2 C C25 R N N 0 1.232 4.383 -0.337
32 OG3 O O7 N N N 0 0.087 4.186 -1.169
33 NBC N N1 N N N 0 1.514 -0.488 -0.812
34 CBD C C26 N N N 0 2.709 -0.776 -0.259
35 OBM O O8 N N N 0 2.808 -0.89 0.945
36 CBE C C27 N N N 0 3.921 -0.956 -1.135
37 CBF C C28 N N N 0 5.138 -1.273 -0.263
38 CBG C C29 N N N 0 6.369 -1.456 -1.153
39 CBH C C30 N N N 0 7.586 -1.773 -0.281
40 CBI C C31 N N N 0 8.817 -1.955 -1.171
41 CBJ C C32 N N N 0 10.034 -2.273 -0.299
42 CBK C C33 N N N 0 11.265 -2.455 -1.188
43 CBO C C34 N Y N 0 12.463 -2.768 -0.329
44 CBR C C35 N Y N 0 13.249 -1.742 0.161
45 CBS C C36 N Y N 0 14.348 -2.028 0.948
46 CBT C C37 N Y N 0 14.661 -3.341 1.246
47 CBU C C38 N Y N 0 13.875 -4.368 0.757
48 CBV C C39 N Y N 0 12.774 -4.081 -0.027
49 H1 H H1 N N N 0 0.348 3.482 1.41
50 H2 H H2 N N N 0 -20.509 -1.607 0.138
51 H3 H H3 N N N 0 -19.549 -2.074 1.562
52 H4 H H4 N N N 0 -19.647 -0.365 1.077
53 H5 H H5 N N N 0 -18.341 -2.602 -0.537
54 H6 H H6 N N N 0 -18.438 -0.892 -1.023
55 H7 H H7 N N N 0 -17.153 -0.245 0.996
56 H8 H H8 N N N 0 -17.055 -1.955 1.482
57 H9 H H9 N N N 0 -15.846 -2.482 -0.618
58 H10 H H10 N N N 0 -15.944 -0.773 -1.104
59 H11 H H11 N N N 0 -14.658 -0.125 0.915
60 H12 H H12 N N N 0 -14.561 -1.835 1.401
61 H13 H H13 N N N 0 -13.352 -2.363 -0.698
62 H14 H H14 N N N 0 -13.45 -0.653 -1.184
63 H15 H H15 N N N 0 -12.164 -0.006 0.835
64 H16 H H16 N N N 0 -12.066 -1.715 1.321
65 H17 H H17 N N N 0 -10.858 -2.243 -0.779
66 H18 H H18 N N N 0 -10.955 -0.534 -1.265
67 H19 H H19 N N N 0 -9.67 0.114 0.754
68 H20 H H20 N N N 0 -9.572 -1.596 1.24
69 H21 H H21 N N N 0 -8.363 -2.123 -0.86
70 H22 H H22 N N N 0 -8.461 -0.414 -1.346
71 H23 H H23 N N N 0 -7.175 0.234 0.674
72 H24 H H24 N N N 0 -7.078 -1.476 1.159
73 H25 H H25 N N N 0 -5.869 -2.004 -0.94
74 H26 H H26 N N N 0 -5.967 -0.294 -1.426
75 H27 H H27 N N N 0 -4.681 0.353 0.593
76 H28 H H28 N N N 0 -4.583 -1.356 1.079
77 H29 H H29 N N N 0 -3.375 -1.884 -1.021
78 H30 H H30 N N N 0 -3.472 -0.175 -1.507
79 H31 H H31 N N N 0 -2.227 0.441 0.586
80 H32 H H32 N N N 0 -1.934 -2.432 0.877
81 H33 H H33 N N N 0 -0.851 -1.611 -1.205
82 H34 H H34 N N N 0 -1.143 1.263 -1.497
83 H35 H H35 N N N 0 0.395 -0.995 0.888
84 H36 H H36 N N N 0 -0.522 1.423 1.187
85 H37 H H37 N N N 0 1.972 1.67 -0.523
86 H38 H H38 N N N 0 3.648 2.316 0.437
87 H39 H H39 N N N 0 5.744 3.432 1.258
88 H40 H H40 N N N 0 4.744 4.455 2.317
89 H41 H H41 N N N 0 5.509 2.491 3.441
90 H42 H H42 N N N 0 4.635 4.188 -0.831
91 H43 H H43 N N N 0 3.815 6.378 -0.343
92 H44 H H44 N N N 0 2.511 3.238 -1.643
93 H45 H H45 N N N 0 1.806 5.207 -2.796
94 H46 H H46 N N N 0 1.203 5.384 0.093
95 H47 H H47 N N N 0 -0.757 4.269 -0.704
96 H48 H H48 N N N 0 1.435 -0.396 -1.775
97 H49 H H49 N N N 0 3.749 -1.777 -1.83
98 H50 H H50 N N N 0 4.105 -0.038 -1.694
99 H51 H H51 N N N 0 5.311 -0.452 0.433
100 H52 H H52 N N N 0 4.955 -2.19 0.296
101 H53 H H53 N N N 0 6.197 -2.277 -1.848
102 H54 H H54 N N N 0 6.553 -0.538 -1.712
103 H55 H H55 N N N 0 7.759 -0.952 0.415
104 H56 H H56 N N N 0 7.403 -2.69 0.278
105 H57 H H57 N N N 0 8.644 -2.777 -1.866
106 H58 H H58 N N N 0 9.0 -1.038 -1.73
107 H59 H H59 N N N 0 10.207 -1.452 0.397
108 H60 H H60 N N N 0 9.851 -3.19 0.261
109 H61 H H61 N N N 0 11.092 -3.277 -1.884
110 H62 H H62 N N N 0 11.448 -1.538 -1.748
111 H63 H H63 N N N 0 13.005 -0.716 -0.072
112 H64 H H64 N N N 0 14.963 -1.227 1.331
113 H65 H H65 N N N 0 15.521 -3.566 1.861
114 H66 H H66 N N N 0 14.12 -5.393 0.989
115 H67 H H67 N N N 0 12.157 -4.882 -0.407