Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 8KI

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 40


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C12 C C1 N N N 0 4.422 -1.051 -0.134
2 C09 C C2 S N N 0 3.119 -0.454 -0.669
3 C02 C C3 S N N 0 2.684 0.637 0.263
4 N01 N N1 N N N 0 2.111 -0.006 1.461
5 C01 C C4 N N N 0 0.83 -0.431 1.383
6 O01 O O1 N N N 0 0.388 -1.171 2.236
7 C10 C C5 N N N 0 2.121 -1.584 -0.861
8 C08 C C6 N N N 0 0.917 -1.091 -1.667
9 O04 O O2 N N N 0 -0.234 -0.919 -0.792
10 C04 C C7 S N N 0 -0.037 0.002 0.263
11 N02 N N2 N N N 0 0.365 1.302 -0.302
12 C03 C C8 N N N 0 1.689 1.578 -0.335
13 O02 O O3 N N N 0 2.074 2.603 -0.857
14 C05 C C9 S N N 0 -1.421 0.245 0.87
15 O05 O O4 N N N 0 -1.568 1.633 1.179
16 C06 C C10 S N N 0 -2.498 -0.17 -0.134
17 C11 C C11 N N N 0 -2.32 0.623 -1.431
18 O06 O O5 N N N 0 -2.379 -1.567 -0.41
19 C07 C C12 N N N 0 -3.881 0.117 0.453
20 O03 O O6 N N N 0 -4.887 -0.27 -0.484
21 H1 H H1 N N N 0 4.241 -1.502 0.842
22 H2 H H2 N N N 0 4.784 -1.813 -0.824
23 H3 H H3 N N N 0 5.17 -0.264 -0.037
24 H7 H H7 N N N 0 2.601 -2.405 -1.394
25 H4 H H4 N N N 0 3.324 -0.01 -1.643
26 H5 H H5 N N N 0 3.561 1.204 0.573
27 H6 H H6 N N N 0 2.632 -0.119 2.271
28 H8 H H8 N N N 0 1.781 -1.936 0.113
29 H9 H H9 N N N 0 1.161 -0.137 -2.134
30 H10 H H10 N N N 0 0.676 -1.821 -2.44
31 H11 H H11 N N N 0 -0.292 1.934 -0.636
32 H12 H H12 N N N 0 -1.527 -0.344 1.781
33 H16 H H16 N N N 0 -2.505 1.68 -1.239
34 H13 H H13 N N N 0 -1.609 2.207 0.402
35 H14 H H14 N N N 0 -1.302 0.493 -1.799
36 H15 H H15 N N N 0 -3.025 0.26 -2.178
37 H17 H H17 N N N 0 -2.481 -2.132 0.368
38 H18 H H18 N N N 0 -4.008 -0.447 1.377
39 H19 H H19 N N N 0 -3.972 1.183 0.664
40 H20 H H20 N N N 0 -5.791 -0.116 -0.178