Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KS0

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 37


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N Y N 0 -3.092 1.213 0.582
2 C13 C C2 N Y N 0 -3.848 -1.051 -0.817
3 C17 C C3 N N N 0 1.416 -1.024 0.428
4 C01 C C4 N N N 0 6.28 -0.491 -0.121
5 C02 C C5 N N N 0 5.008 0.309 0.167
6 C03 C C6 N N N 0 3.822 -0.621 0.178
7 N04 N N1 N N N 0 2.587 -0.135 0.413
8 C05 C C7 N N N 0 2.375 1.3 0.661
9 C06 C C8 N N N 0 1.267 1.796 -0.274
10 N07 N N2 N N N 0 0.075 0.954 -0.106
11 C08 C C9 N N N 0 -1.064 1.499 -0.856
12 C09 C C10 N Y N 0 -2.319 0.76 -0.471
13 C11 C C11 N Y N 0 -4.244 0.535 0.937
14 C16 C C14 N N N 0 0.346 -0.436 -0.497
15 C12 C C12 N Y N 0 -2.697 -0.372 -1.17
16 C14 C C13 N Y N 0 -4.626 -0.595 0.234
17 F15 F F1 N N N 0 -5.751 -1.258 0.579
18 O18 O O1 N N N 0 3.979 -1.806 -0.025
19 H1 H H1 N N N 0 -2.794 2.094 1.131
20 H2 H H2 N N N 0 -4.141 -1.937 -1.361
21 H3 H H3 N N N 0 1.703 -2.014 0.073
22 H4 H H4 N N N 0 1.023 -1.096 1.443
23 H5 H H5 N N N 0 6.191 -0.977 -1.092
24 H6 H H6 N N N 0 7.138 0.182 -0.129
25 H7 H H7 N N N 0 6.418 -1.246 0.653
26 H8 H H8 N N N 0 5.097 0.796 1.138
27 H9 H H9 N N N 0 4.871 1.064 -0.607
28 H10 H H10 N N N 0 2.075 1.451 1.698
29 H12 H H12 N N N 0 1.02 2.829 -0.028
30 H11 H H11 N N N 0 3.296 1.846 0.46
31 H13 H H13 N N N 0 1.61 1.74 -1.307
32 H15 H H15 N N N 0 -1.18 2.558 -0.623
33 H16 H H16 N N N 0 -0.887 1.38 -1.925
34 H17 H H17 N N N 0 -4.845 0.887 1.762
35 H18 H H18 N N N 0 -2.09 -0.727 -1.99
36 H19 H H19 N N N 0 0.702 -0.461 -1.527
37 H20 H H20 N N N 0 -0.569 -1.022 -0.414