Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 4B6

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 N1 N N1 N N N 0 5.992 0.271 -0.275
2 N3 N N2 N N N 0 -2.73 -0.937 -0.277
3 C4 C C1 N Y N 0 2.664 1.734 0.267
4 C5 C C2 N Y N 0 4.035 1.61 0.178
5 C6 C C3 N Y N 0 4.601 0.394 -0.186
6 C7 C C4 N N N 0 6.586 -0.897 0.039
7 C8 C C5 N N N 0 8.069 -1.069 -0.168
8 C10 C C6 N Y N 0 -0.226 1.919 0.445
9 C13 C C7 N Y N 0 -4.413 0.76 -0.623
10 C15 C C8 N Y N 0 -6.717 0.27 -0.192
11 C17 C C9 N Y N 0 -5.059 -1.426 0.145
12 C1 C C10 N Y N 0 3.788 -0.698 -0.463
13 C11 C C11 N Y N 0 -1.722 -0.012 -0.051
14 C12 C C12 N Y N 0 -4.069 -0.533 -0.252
15 C14 C C13 N Y N 0 -5.735 1.158 -0.592
16 C16 C C14 N Y N 0 -6.38 -1.019 0.178
17 C2 C C15 N Y N 0 2.417 -0.579 -0.376
18 C3 C C16 N Y N 0 1.847 0.638 -0.004
19 C9 C C17 N Y N 0 0.373 0.769 0.091
20 F1 F F1 N N N 0 -4.729 -2.685 0.506
21 N2 N N3 N Y N 0 -0.451 -0.245 -0.168
22 O1 O O1 N N N 0 5.927 -1.811 0.49
23 S1 S S1 N Y N 0 -1.969 1.659 0.446
24 H1 H H1 N N N 0 6.528 1.024 -0.567
25 H2 H H2 N N N 0 -2.506 -1.864 -0.453
26 H3 H H3 N N N 0 2.224 2.679 0.55
27 H4 H H4 N N N 0 4.668 2.458 0.392
28 H5 H H5 N N N 0 8.606 -0.331 0.427
29 H6 H H6 N N N 0 8.365 -2.071 0.14
30 H7 H H7 N N N 0 8.306 -0.928 -1.223
31 H8 H H8 N N N 0 0.275 2.844 0.69
32 H9 H H9 N N N 0 -3.646 1.456 -0.93
33 H10 H H10 N N N 0 -7.75 0.586 -0.165
34 H11 H H11 N N N 0 4.231 -1.642 -0.747
35 H12 H H12 N N N 0 -6.003 2.164 -0.88
36 H13 H H13 N N N 0 -7.15 -1.709 0.49
37 H14 H H14 N N N 0 1.786 -1.428 -0.591