Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 329

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 22


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N Y N 0 0.633 1.962 0.495
2 C2 C C2 N Y N 0 -0.031 0.751 0.588
3 O1 O O1 N N N 0 -1.289 0.55 1.085
4 C3 C C3 S N N 0 -2.304 0.21 0.145
5 C4 C C4 N N N 0 -2.757 1.475 -0.587
6 N1 N N1 N N N 0 -1.016 -1.892 -0.273
7 C5 C C5 N N N 0 0.228 -1.676 0.108
8 N2 N N2 N N N 0 1.043 -2.716 0.51
9 C6 C C6 N Y N 0 0.716 -0.289 0.087
10 S1 S S1 N Y N 0 2.242 0.314 -0.521
11 C7 C C7 N Y N 0 1.843 1.911 -0.068
12 C8 C C8 N N N 0 -1.776 -0.801 -0.874
13 H1 H H1 N N N 0 0.201 2.886 0.848
14 H3 H H3 N N N 0 -3.153 -0.223 0.674
15 H4 H H4 N N N 0 -1.908 1.917 -1.109
16 H4A H H4A N N N 0 -3.534 1.219 -1.308
17 H7 H H7 N N N 0 2.484 2.767 -0.217
18 H4B H H4B N N N 0 -3.152 2.191 0.134
19 HN2 H HN2 N N N 0 0.703 -3.625 0.516
20 HN2A H HN2A N N N 0 1.956 -2.538 0.786
21 H8 H H8 N N N 0 -2.622 -1.222 -1.418
22 H8A H H8A N N N 0 -1.135 -0.279 -1.584