Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : BTN

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 32


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C10 N N N 0 3.896 0.631 0.039
2 C11 C C11 N N N 0 5.089 -0.28 0.173
3 C2 C C2 S N N 0 -1.015 0.819 -0.863
4 C3 C C3 N N N 0 -3.141 -1.549 0.271
5 C4 C C4 S N N 0 -2.289 0.01 -1.175
6 C5 C C5 R N N 0 -3.53 0.581 -0.476
7 C6 C C6 N N N 0 -3.205 1.827 0.371
8 C7 C C7 N N N 0 0.196 -0.106 -0.727
9 C8 C C8 N N N 0 1.44 0.725 -0.412
10 C9 C C9 N N N 0 2.651 -0.2 -0.276
11 H101 H H101 N N N 0 3.745 1.171 0.974
12 H102 H H102 N N N 0 4.071 1.343 -0.767
13 H2 H H2 N N N 0 -0.838 1.576 -1.627
14 H4 H H4 N N N 0 -2.451 -0.038 -2.252
15 H5 H H5 N N N 0 -4.307 0.812 -1.205
16 H61 H H61 N N N 0 -3.797 1.837 1.286
17 H62 H H62 N N N 0 -3.367 2.738 -0.205
18 H71 H H71 N N N 0 0.346 -0.646 -1.662
19 H72 H H72 N N N 0 0.02 -0.818 0.079
20 H81 H H81 N N N 0 1.289 1.265 0.523
21 H82 H H82 N N N 0 1.616 1.437 -1.218
22 H91 H H91 N N N 0 2.802 -0.74 -1.211
23 H92 H H92 N N N 0 2.476 -0.912 0.53
24 HN1 H HN1 N N N 0 -4.738 -0.474 1.004
25 HN2 H HN2 N N N 0 -1.462 -1.982 -0.843
26 HO2 H HO2 N N Y 0 7.034 -0.391 0.517
27 N1 N N1 N N N 0 -3.97 -0.507 0.412
28 N2 N N2 N N N 0 -2.154 -1.343 -0.612
29 O11 O O11 N N N 0 4.956 -1.473 0.03
30 O12 O O12 N N Y 0 6.299 0.233 0.444
31 O3 O O3 N N N 0 -3.271 -2.589 0.888
32 S1 S S1 N N N 0 -1.419 1.604 0.751