Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : CWB

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 47


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 O13 O O13 N N N 0 0.665 -2.241 0.071
2 C12 C C12 N N N 0 0.481 -1.039 0.114
3 C14 C C14 N Y N 0 1.629 -0.116 0.079
4 C23 C C23 N Y N 0 3.05 -0.481 -0.004
5 C22 C C22 N Y N 0 3.768 -1.671 -0.074
6 C21 C C21 N Y N 0 5.133 -1.631 -0.144
7 C20 C C20 N Y N 0 5.804 -0.415 -0.145
8 C19 C C19 N Y N 0 5.118 0.765 -0.078
9 C18 C C18 N Y N 0 3.728 0.754 -0.006
10 N16 N N16 N Y N 0 2.759 1.719 0.071
11 C17 C C17 N N N 0 3.026 3.159 0.096
12 N15 N N15 N Y N 0 1.586 1.199 0.112
13 N11 N N11 N N N 0 -0.774 -0.552 0.186
14 C09 C C09 N N N 0 -1.911 -1.465 0.214
15 C10 C C10 N N N 0 -2.669 -1.468 -1.107
16 C03 C C03 S N N 0 -3.62 -0.274 -1.227
17 C08 C C08 N N N 0 -2.819 -1.205 1.41
18 C07 C C07 R N N 0 -3.762 -0.024 1.168
19 N02 N N02 N N N 0 -4.498 -0.25 -0.067
20 C01 C C01 N N N 0 -5.724 0.507 -0.219
21 C06 C C06 N N N 0 -2.987 1.285 1.14
22 C05 C C05 N N N 0 -3.04 1.975 -0.214
23 C04 C C04 N N N 0 -2.838 1.021 -1.38
24 H11 H H11 N N N 0 -0.92 0.407 0.22
25 H22 H H22 N N N 0 3.25 -2.619 -0.073
26 H21 H H21 N N N 0 5.693 -2.553 -0.198
27 H20 H H20 N N N 0 6.882 -0.402 -0.2
28 H19 H H19 N N N 0 5.652 1.703 -0.079
29 H171 H H171 N N N 0 3.039 3.545 -0.923
30 H172 H H172 N N N 0 2.245 3.664 0.665
31 H173 H H173 N N N 0 3.992 3.341 0.566
32 H09 H H09 N N N 0 -1.49 -2.488 0.346
33 H101 H H101 N N N 0 -1.957 -1.436 -1.937
34 H102 H H102 N N N 0 -3.251 -2.391 -1.19
35 H081 H H081 N N N 0 -3.417 -2.099 1.613
36 H082 H H082 N N N 0 -2.208 -0.994 2.292
37 H03 H H03 N N N 0 -4.233 -0.42 -2.128
38 H041 H H041 N N N 0 -1.776 0.81 -1.517
39 H042 H H042 N N N 0 -3.177 1.523 -2.303
40 H07 H H07 N N N 0 -4.478 0.013 2.002
41 H061 H H061 N N N 0 -3.427 1.962 1.893
42 H062 H H062 N N N 0 -1.951 1.12 1.441
43 H011 H H011 N N N 0 -6.311 0.087 -1.036
44 H012 H H012 N N N 0 -6.299 0.455 0.706
45 H013 H H013 N N N 0 -5.484 1.547 -0.44
46 H051 H H051 N N N 0 -3.983 2.517 -0.326
47 H052 H H052 N N N 0 -2.241 2.736 -0.246