Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : O1X

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 28


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N Y N 0 -3.624 -1.607 -0.028
2 C4 C C1 N Y N 0 -2.021 0.104 -0.213
3 C5 C C2 N Y N 0 -2.388 -1.233 -0.291
4 C6 C C3 N Y N 0 -4.555 -0.739 0.316
5 C7 C C4 N Y N 0 -4.266 0.609 0.415
6 C8 C C5 N Y N 0 -2.98 1.048 0.147
7 O1 O O1 N N N 0 0.107 -1.408 0.297
8 C3 C C6 N N N 0 0.321 -0.308 -0.166
9 C1 C C7 S N N 0 1.739 0.157 -0.376
10 O O O2 N N N 0 2.644 -0.867 0.043
11 C2 C C8 N N N 0 3.893 -0.374 0.531
12 F1 F F1 N N N 0 4.533 0.355 -0.477
13 F F F2 N N N 0 3.668 0.456 1.635
14 C C C9 N N N 0 1.963 0.459 -1.859
15 N N N2 N N N 0 -0.708 0.498 -0.493
16 C9 C C10 N N N 0 -2.627 2.51 0.244
17 H1 H H1 N N N 0 -1.653 -1.973 -0.57
18 H2 H H2 N N N 0 -5.556 -1.087 0.524
19 H3 H H3 N N N 0 -5.036 1.313 0.698
20 H4 H H4 N N N 0 1.916 1.06 0.209
21 H5 H H5 N N N 0 4.523 -1.212 0.829
22 H6 H H6 N N N 0 1.786 -0.443 -2.444
23 H7 H H7 N N N 0 1.273 1.24 -2.179
24 H8 H H8 N N N 0 2.988 0.796 -2.011
25 H9 H H9 N N N 0 -0.538 1.351 -0.922
26 H10 H H10 N N N 0 -2.791 2.988 -0.722
27 H11 H H11 N N N 0 -3.255 2.986 0.996
28 H12 H H12 N N N 0 -1.579 2.612 0.527