Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : OCA

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 26


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N N N 0 -5.587 2.352 6.172
2 C2 C C2 N N N 0 -5.974 1.52 4.97
3 C3 C C3 N N N 0 -4.981 1.687 3.82
4 C4 C C4 N N N 0 -5.346 0.869 2.577
5 C5 C C5 N N N 0 -4.357 0.954 1.41
6 C6 C C6 N N N 0 -4.761 0.1 0.207
7 C7 C C7 N N N 0 -3.736 0.216 -0.923
8 C8 C C8 N N N 0 -4.151 -0.601 -2.137
9 O1 O O1 N N N 0 -4.599 3.068 6.252
10 O2 O O2 N N Y 0 -6.488 2.214 7.18
11 H21 H 1H2 N N N 0 -6.007 0.469 5.277
12 H22 H 2H2 N N N 0 -6.974 1.836 4.655
13 H31 H 1H3 N N N 0 -3.985 1.369 4.154
14 H32 H 2H3 N N N 0 -4.885 2.747 3.56
15 H41 H 1H4 N N N 0 -6.332 1.191 2.219
16 H61 H 1H6 N N N 0 -4.848 -0.951 0.504
17 H42 H 2H4 N N N 0 -5.455 -0.181 2.874
18 H51 H 1H5 N N N 0 -4.291 2.004 1.098
19 H52 H 2H5 N N N 0 -3.353 0.671 1.747
20 H62 H 2H6 N N N 0 -5.746 0.418 -0.157
21 H71 H 1H7 N N N 0 -3.624 1.265 -1.218
22 H72 H 2H7 N N N 0 -2.757 -0.13 -0.574
23 H81 H 1H8 N N N 0 -4.242 -1.662 -1.883
24 H82 H 2H8 N N N 0 -3.404 -0.504 -2.931
25 H83 H 3H8 N N N 0 -5.112 -0.258 -2.531
26 HO2 H HO2 N N N 0 -6.288 2.737 7.987