Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : OX0

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 54


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N N N 0 2.095 -1.138 -0.583
2 C02 C C2 N N N 0 4.509 3.248 -1.377
3 C03 C C3 N Y N 0 4.58 2.342 -0.271
4 C04 C C4 N Y N 0 4.812 2.826 1.017
5 C06 C C5 N Y N 0 4.716 0.59 1.869
6 C07 C C6 N Y N 0 4.479 0.104 0.595
7 C08 C C7 N N N 0 4.302 -1.376 0.376
8 C01 C C8 N N N 0 4.45 3.991 -2.284
9 C05 C C9 N Y N 0 4.879 1.947 2.079
10 C11 C C10 N N N 0 0.662 -1.593 -0.507
11 C12 C C11 N N N 0 -0.318 -0.86 -1.225
12 C17 C C15 N Y N 0 -3.072 2.869 -0.237
13 C14 C C12 N N N 0 -2.609 -0.47 -1.937
14 C15 C C13 N Y N 0 -3.164 0.622 -1.059
15 C16 C C14 N Y N 0 -2.564 1.867 -1.042
16 C18 C C16 N Y N 0 -4.182 2.625 0.552
17 C20 C C17 N Y N 0 -4.782 1.379 0.535
18 C21 C C18 N Y N 0 -4.276 0.38 -0.275
19 C22 C C19 N N N 0 -1.992 -2.343 -0.451
20 C24 C C20 N N N 0 -3.165 -4.017 0.555
21 C25 C C21 N N N 0 -1.682 -4.163 0.942
22 C28 C C22 N N N 0 0.285 -2.662 0.213
23 C29 C C23 N N N 0 1.272 -3.478 1.008
24 C30 C C24 N N N 0 2.696 -3.183 0.536
25 C31 C C25 N Y N 0 4.41 0.972 -0.475
26 N09 N N1 N N N 0 2.881 -1.724 0.507
27 N13 N N2 N N N 0 -1.606 -1.234 -1.191
28 N23 N N3 N N N 0 -3.19 -2.837 -0.316
29 N26 N N4 N N N 0 -1.036 -3.04 0.241
30 O27 O O1 N N N 0 0.013 0.115 -1.877
31 CL19 CL CL1 N N N 0 -4.821 3.883 1.564
32 H102 H H1 N N N 0 2.52 -1.446 -1.538
33 H101 H H2 N N N 0 2.131 -0.051 -0.508
34 H041 H H3 N N N 0 4.94 3.885 1.182
35 H061 H H4 N N N 0 4.769 -0.093 2.704
36 H082 H H5 N N N 0 4.65 -1.64 -0.623
37 H081 H H6 N N N 0 4.881 -1.925 1.119
38 H142 H H9 N N N 0 -3.417 -1.134 -2.245
39 H011 H H7 N N N 0 4.398 4.655 -3.096
40 H051 H H8 N N N 0 5.06 2.32 3.077
41 H141 H H10 N N N 0 -2.146 -0.027 -2.819
42 H161 H H11 N N N 0 -1.697 2.057 -1.658
43 H171 H H12 N N N 0 -2.603 3.842 -0.223
44 H201 H H13 N N N 0 -5.649 1.188 1.151
45 H211 H H14 N N N 0 -4.748 -0.592 -0.292
46 H241 H H15 N N N 0 -3.507 -4.898 0.013
47 H242 H H16 N N N 0 -3.778 -3.851 1.441
48 H251 H H17 N N N 0 -1.555 -4.067 2.021
49 H252 H H18 N N N 0 -1.285 -5.116 0.591
50 H291 H H19 N N N 0 1.182 -3.227 2.065
51 H292 H H20 N N N 0 1.058 -4.538 0.871
52 H301 H H21 N N N 0 3.411 -3.631 1.226
53 H302 H H22 N N N 0 2.844 -3.592 -0.464
54 H311 H H23 N N N 0 4.226 0.591 -1.469