Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 16W

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 43


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 -3.942 0.636 0.618
2 C2 C C2 N Y N 0 -3.032 0.36 -0.391
3 C3 C C3 N Y N 0 -3.455 0.315 -1.712
4 C7 C C7 N Y N 0 2.568 -3.54 0.895
5 C8 C C8 N Y N 0 2.394 -1.344 0.233
6 C9 C C9 N Y N 0 1.058 -1.581 -0.147
7 C10 C C10 N Y N 0 0.536 -2.877 0.023
8 C13 C C13 N N N 0 5.744 1.988 -0.877
9 C11 C C11 N Y N 0 0.55 -0.364 -0.651
10 C12 C C12 N N N 0 -0.845 -0.143 -1.177
11 C14 C C14 N N N 0 5.006 2.601 1.322
12 C15 C C15 N N N 0 3.692 1.835 1.147
13 C16 C C16 N N N 0 3.918 0.661 0.19
14 N2 N N2 N Y N 0 3.103 -2.348 0.746
15 N4 N N4 N Y N 0 1.323 -3.811 0.548
16 N5 N N5 N Y N 0 2.649 -0.033 -0.042
17 N1 N N1 N Y N 0 1.49 0.535 -0.585
18 N3 N N3 N N N 0 -0.766 -3.168 -0.332
19 O2 O O2 N N N 0 -1.727 0.135 -0.087
20 O1 O O1 N N N 0 5.47 3.045 0.045
21 C17 C C17 N N N 0 4.459 1.197 -1.139
22 C4 C C4 N Y N 0 -4.782 0.545 -2.019
23 C5 C C5 N Y N 0 -5.689 0.82 -1.012
24 H4 H H4 N N N 0 -0.844 0.701 -1.867
25 C6 C C6 N Y N 0 -5.27 0.865 0.306
26 CL1 CL CL1 N N N 0 -6.412 1.203 1.568
27 H1 H H1 N N N 0 -3.616 0.667 1.647
28 H2 H H2 N N N 0 -2.748 0.101 -2.499
29 H3 H H3 N N N 0 3.173 -4.33 1.314
30 H5 H H5 N N N 0 -1.183 -1.038 -1.699
31 H6 H H6 N N N 0 6.11 2.408 -1.813
32 H7 H H7 N N N 0 6.499 1.325 -0.455
33 H8 H H8 N N N 0 4.841 3.463 1.968
34 H9 H H9 N N N 0 5.752 1.946 1.772
35 H10 H H10 N N N 0 3.36 1.458 2.114
36 H11 H H11 N N N 0 2.934 2.501 0.736
37 H12 H H12 N N N 0 4.64 -0.031 0.625
38 H13 H H13 N N N 0 -1.364 -2.456 -0.61
39 H14 H H14 N N N 0 -1.084 -4.084 -0.305
40 H15 H H15 N N N 0 3.717 1.85 -1.598
41 H16 H H16 N N N 0 4.675 0.363 -1.807
42 H17 H H17 N N N 0 -5.112 0.51 -3.047
43 H18 H H18 N N N 0 -6.726 0.999 -1.255