Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 0CB

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 69


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C13 C C13 N Y N 0 -3.706 -4.247 0.12
2 C14 C C14 N Y N 0 -2.733 -5.124 0.475
3 C16 C C16 N Y N 0 -1.004 -3.589 -0.247
4 C22 C C22 N N N 0 -0.335 -5.782 0.692
5 C1 C C1 N Y N 0 -4.35 -2.076 -0.81
6 C2 C C2 N Y N 0 -3.986 -0.878 -1.345
7 C3 C C3 N Y N 0 -2.644 -0.552 -1.527
8 C4 C C4 N Y N 0 -1.658 -1.422 -1.176
9 C5 C C5 N Y N 0 -1.995 -2.669 -0.62
10 C6 C C6 N Y N 0 -3.362 -3.001 -0.435
11 O36 O O36 N N N 0 -4.012 2.951 -1.598
12 S32 S S32 N N N 0 -3.165 2.738 -0.477
13 O38 O O38 N N N 0 -2.455 3.814 0.12
14 C34 C C34 N N N 0 -4.02 1.76 0.789
15 C53 C C53 N N N 0 -4.995 2.638 1.53
16 O57 O O57 N N N 0 -5.744 2.125 2.518
17 O54 O O54 N N N 0 -5.102 3.805 1.234
18 N30 N N30 N N N 0 -1.98 1.732 -1.046
19 C28 C C28 N N N 0 -2.278 0.783 -2.122
20 C15 C C15 N Y N 0 -1.375 -4.806 0.296
21 N26 N N26 N N N 0 -0.698 -6.996 1.234
22 N24 N N24 N N N 0 0.925 -5.493 0.529
23 C40 C C40 N Y N 0 -0.692 1.788 -0.5
24 C46 C C46 N Y N 0 -0.51 2.225 0.805
25 C45 C C45 N Y N 0 0.76 2.28 1.344
26 C44 C C44 N Y N 0 1.854 1.899 0.581
27 C43 C C43 N Y N 0 1.673 1.462 -0.723
28 C42 C C42 N Y N 0 0.403 1.401 -1.261
29 O59 O O59 N N N 0 3.105 1.953 1.112
30 C61 C C61 N N N 0 4.192 1.608 0.25
31 C67 C C67 N N N 0 4.369 0.088 0.238
32 C66 C C66 N N N 0 5.511 -0.281 -0.714
33 N65 N N65 N N N 0 6.715 0.464 -0.319
34 C74 C C74 N N N 0 7.893 -0.192 -0.078
35 C76 C C76 N N N 0 9.087 0.57 0.437
36 N82 N N82 N N N 0 7.982 -1.464 -0.292
37 C64 C C64 N N N 0 6.63 1.925 -0.188
38 C63 C C63 N N N 0 5.475 2.269 0.757
39 H1 H H1 N N N 0 -4.745 -4.507 0.26
40 H2 H H2 N N N 0 -3.005 -6.079 0.9
41 H3 H H3 N N N 0 0.04 -3.35 -0.382
42 H4 H H4 N N N 0 -5.395 -2.315 -0.674
43 H5 H H5 N N N 0 -4.749 -0.17 -1.632
44 H6 H H6 N N N 0 -0.621 -1.157 -1.324
45 H7 H H7 N N N 0 -4.558 0.94 0.313
46 H8 H H8 N N N 0 -3.289 1.356 1.49
47 H9 H H9 N N N 0 -6.355 2.727 2.964
48 H10 H H10 N N N 0 -1.401 0.669 -2.76
49 H11 H H11 N N N 0 -3.113 1.158 -2.715
50 H12 H H12 N N N 0 -1.636 -7.211 1.356
51 H13 H H13 N N N 0 -0.016 -7.635 1.494
52 H14 H H14 N N N 0 1.607 -6.132 0.789
53 H15 H H15 N N N 0 -1.362 2.522 1.399
54 H16 H H16 N N N 0 0.902 2.62 2.359
55 H17 H H17 N N N 0 2.526 1.166 -1.316
56 H18 H H18 N N N 0 0.262 1.061 -2.276
57 H19 H H19 N N N 0 3.978 1.957 -0.761
58 H20 H H20 N N N 0 4.607 -0.259 1.243
59 H21 H H21 N N N 0 3.446 -0.383 -0.101
60 H22 H H22 N N N 0 5.707 -1.352 -0.652
61 H23 H H23 N N N 0 5.236 -0.017 -1.735
62 H24 H H24 N N N 0 9.076 0.571 1.527
63 H25 H H25 N N N 0 10.002 0.094 0.083
64 H26 H H26 N N N 0 9.048 1.597 0.073
65 H27 H H27 N N N 0 7.246 -1.937 -0.711
66 H28 H H28 N N N 0 7.564 2.31 0.221
67 H29 H H29 N N N 0 6.446 2.369 -1.166
68 H30 H H30 N N N 0 5.34 3.35 0.788
69 H31 H H31 N N N 0 5.702 1.902 1.758