Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 0LI

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 66


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N Y N 0 -9.896 -0.371 -0.385
2 N3 N N3 N N N 0 6.438 -1.243 -0.016
3 C4 C C4 N N N 0 -5.381 1.078 -0.489
4 C5 C C5 N Y N 0 -4.094 1.696 -0.596
5 C6 C C6 N Y N 0 -3.98 3.005 -1.075
6 C7 C C7 N Y N 0 -2.739 3.6 -1.178
7 C8 C C8 N Y N 0 -1.602 2.91 -0.809
8 C10 C C10 N Y N 0 -2.948 0.995 -0.215
9 C13 C C13 N Y N 0 1.889 0.722 0.224
10 C15 C C15 N Y N 0 3.101 -1.346 0.153
11 C17 C C17 N Y N 0 4.131 0.615 1.07
12 C20 C C20 N N N 0 5.44 -1.518 1.026
13 C21 C C21 N N N 0 7.773 -1.695 0.401
14 C22 C C22 N N N 0 8.795 -1.32 -0.675
15 C24 C C24 N N N 0 6.051 -1.862 -1.292
16 C81 C C81 N Y N 0 -9.906 -2.715 0.492
17 C82 C C82 N Y N 0 -9.079 -3.701 0.942
18 C83 C C83 N Y N 0 -7.697 -3.489 0.997
19 N81 N N81 N Y N 0 -7.177 -2.35 0.621
20 N82 N N82 N Y N 0 -7.992 -1.315 0.154
21 C84 C C84 N Y N 0 -9.351 -1.487 0.086
22 C1 C C1 N Y N 0 -8.945 0.522 -0.627
23 C2 C C2 N Y N 0 -7.725 -0.045 -0.296
24 C3 C C3 N N N 0 -6.437 0.572 -0.402
25 C9 C C9 N Y N 0 -1.699 1.601 -0.328
26 C11 C C11 N N N 0 -5.216 3.767 -1.481
27 C12 C C12 N N N 0 -0.479 0.865 0.067
28 O1 O O1 N N N 0 -0.565 -0.273 0.485
29 N2 N N2 N N N 0 0.728 1.455 -0.038
30 C14 C C14 N Y N 0 1.952 -0.625 -0.108
31 C16 C C16 N Y N 0 4.188 -0.728 0.743
32 C18 C C18 N Y N 0 2.985 1.341 0.812
33 C19 C C19 N N N 0 5.318 1.284 1.714
34 F1 F F1 N N N 0 4.988 2.603 2.042
35 F2 F F2 N N N 0 5.672 0.589 2.875
36 F3 F F3 N N N 0 6.395 1.281 0.821
37 C23 C C23 N N N 0 7.073 -1.487 -2.368
38 C25 C C25 N N N 0 9.406 -1.664 -2.993
39 N4 N N4 N N N 0 8.408 -1.939 -1.951
40 H7 H H7 N N N 0 -2.657 4.611 -1.55
41 H8 H H8 N N N 0 -0.634 3.382 -0.893
42 H10 H H10 N N N 0 -3.029 -0.015 0.16
43 H15 H H15 N N N 0 3.151 -2.394 -0.105
44 H20 H H20 N N N 0 5.204 -2.582 1.032
45 H20A H H20A N N N 0 5.84 -1.229 1.998
46 H21 H H21 N N N 0 8.042 -1.214 1.341
47 H21A H H21A N N N 0 7.766 -2.777 0.535
48 H22 H H22 N N N 0 8.822 -0.237 -0.79
49 H22A H H22A N N N 0 9.781 -1.68 -0.381
50 H24 H H24 N N N 0 6.024 -2.946 -1.177
51 H24A H H24A N N N 0 5.065 -1.502 -1.586
52 H81 H H81 N N N 0 -10.973 -2.874 0.448
53 H82 H H82 N N N 0 -9.492 -4.648 1.256
54 H83 H H83 N N N 0 -7.051 -4.277 1.356
55 H1 H H1 N N N 0 -9.095 1.518 -1.016
56 H11 H H11 N N N 0 -5.607 4.31 -0.62
57 H11A H H11A N N N 0 -4.964 4.473 -2.272
58 H11B H H11B N N N 0 -5.97 3.069 -1.844
59 HN2 H HN2 N N N 0 0.79 2.388 -0.295
60 H14 H H14 N N N 0 1.103 -1.108 -0.568
61 H18 H H18 N N N 0 2.941 2.39 1.067
62 H23 H H23 N N N 0 6.804 -1.969 -3.308
63 H23A H H23A N N N 0 7.08 -0.406 -2.502
64 H25 H H25 N N N 0 10.371 -2.069 -2.687
65 H25A H H25A N N N 0 9.095 -2.134 -3.927
66 H25B H H25B N N N 0 9.493 -0.588 -3.139