Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : AES

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 23


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C3 C C3 N Y N 0 1.226 -1.19 0.349
2 C2 C C2 N Y N 0 -0.139 -1.194 0.135
3 C1 C C1 N Y N 0 -0.826 0.001 0.03
4 S S S N N N 0 -2.566 -0.003 -0.244
5 F F F N N Y 0 -3.276 -0.008 1.201
6 O1S O O1S N N N 0 -2.882 1.246 -0.842
7 O2S O O2S N N N 0 -2.874 -1.253 -0.846
8 C6 C C6 N Y N 0 -0.147 1.201 0.139
9 C5 C C5 N Y N 0 1.219 1.204 0.354
10 C4 C C4 N Y N 0 1.906 0.009 0.458
11 C7 C C7 N N N 0 3.394 0.013 0.692
12 C8 C C8 N N N 0 4.122 0.017 -0.654
13 N8 N N8 N N N 0 5.573 0.021 -0.426
14 H3 H H3 N N N 0 1.762 -2.124 0.436
15 H2 H H2 N N N 0 -0.67 -2.131 0.05
16 H6 H H6 N N N 0 -0.683 2.134 0.057
17 H5 H H5 N N N 0 1.75 2.141 0.439
18 H71 H H71 N N N 0 3.671 0.903 1.257
19 H72 H H72 N N N 0 3.676 -0.877 1.255
20 H81 H H81 N N N 0 3.846 -0.873 -1.219
21 H82 H H82 N N N 0 3.84 0.907 -1.217
22 HN81 H HN81 N N N 0 5.851 -0.76 0.149
23 HN82 H HN82 N N N 0 6.077 0.023 -1.3