Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : NTI

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 30


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 S S S N Y N 0 2.887 -1.349 -0.249
2 C1 C C1 N Y N 0 -2.271 -0.868 0.166
3 N1 N N1 N N N 0 0.161 -1.048 -0.019
4 O1 O O1 N N N 0 -3.25 1.245 0.706
5 C2 C C2 N Y N 0 -3.397 -0.073 0.414
6 N2 N N2 N Y N 0 1.692 0.749 0.3
7 O2 O O2 N N N 0 -0.78 0.9 0.481
8 C3 C C3 N N N 0 -0.919 -0.279 0.22
9 N3 N N3 N N N 1 5.293 0.24 -0.029
10 O3 O O3 N N N 0 -3.359 1.689 -1.457
11 C4 C C4 N Y N 0 -2.434 -2.224 -0.128
12 O4 O O4 N N N 0 5.826 1.314 0.184
13 C5 C C5 N Y N 0 -4.662 -0.637 0.361
14 O5 O O5 N N N -1 5.973 -0.735 -0.292
15 C6 C C6 N Y N 0 -3.699 -2.77 -0.171
16 C7 C C7 N Y N 0 1.434 -0.493 0.032
17 C8 C C8 N Y N 0 -4.811 -1.977 0.064
18 C9 C C9 N Y N 0 3.818 0.121 0.031
19 C10 C C10 N Y N 0 2.963 1.107 0.307
20 C11 C C11 N N N 0 -3.189 2.096 -0.332
21 C12 C C12 N N N 0 -2.909 3.557 -0.093
22 HN1 H HN1 N N N 0 0.051 -1.989 -0.227
23 H4 H H4 N N N 0 -1.571 -2.844 -0.32
24 H5 H H5 N N N 0 -5.533 -0.027 0.551
25 H6 H H6 N N N 0 -3.825 -3.818 -0.398
26 H8 H H8 N N N 0 -5.798 -2.412 0.024
27 H10 H H10 N N N 0 3.283 2.116 0.518
28 H12 H H12 N N N 0 -1.834 3.73 -0.123
29 H12A H H12A N N N 0 -3.395 4.151 -0.867
30 H12B H H12B N N N 0 -3.297 3.846 0.884