Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : A8W

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 59


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C8 C C1 S N N 0 -1.531 0.881 0.034
2 C5 C C2 N N N 0 1.232 0.589 0.358
3 C6 C C3 N N N 0 0.766 1.788 0.164
4 C2 C C4 N N N 0 2.632 -1.85 -0.123
5 C4 C C5 N N N 0 2.655 0.444 0.87
6 O O O1 N N N 0 -6.653 -0.013 1.153
7 C1 C C6 N N N 0 1.265 -1.614 -0.768
8 C10 C C7 R N N 0 0.445 -0.664 0.11
9 C11 C C8 N N N 0 -1.819 -1.613 -0.312
10 C12 C C9 N N N 0 -3.23 -1.37 -0.871
11 C13 C C10 S N N 0 -3.779 -0.135 -0.177
12 C14 C C11 S N N 0 -2.889 1.058 -0.617
13 C15 C C12 N N N 0 -3.697 2.277 -0.189
14 C16 C C13 N N N 0 -5.179 1.83 -0.256
15 C17 C C14 S N N 0 -5.165 0.325 -0.642
16 C18 C C15 N N N 0 -3.733 -0.31 1.342
17 C19 C C16 N N N 0 0.203 -1.35 1.456
18 C20 C C17 N N N 0 -6.249 -0.423 0.091
19 C3 C C18 S N N 0 3.401 -0.53 -0.047
20 C7 C C19 N N N 0 -0.621 2.055 -0.345
21 C9 C C20 S N N 0 -0.91 -0.406 -0.526
22 O1 O O2 N N N 0 4.709 -0.77 0.476
23 O2 O O3 N N N 0 7.031 -0.384 0.349
24 O3 O O4 N N N 0 5.479 0.249 -1.506
25 O4 O O5 N N N 0 5.624 1.503 0.485
26 S S S1 N N N 0 5.789 0.118 -0.125
27 C21 C C21 N N N 0 -6.828 -1.682 -0.501
28 H3 H H1 N N N 0 -1.625 0.813 1.118
29 H18 H H2 N N N 0 1.406 2.63 0.38
30 H21 H H3 N N N 0 2.494 -2.247 0.883
31 H22 H H4 N N N 0 3.196 -2.565 -0.721
32 H24 H H5 N N N 0 3.151 1.414 0.856
33 H23 H H6 N N N 0 2.641 0.053 1.887
34 H20 H H7 N N N 0 1.4 -1.171 -1.755
35 H19 H H8 N N N 0 0.739 -2.564 -0.865
36 H14 H H9 N N N 0 -1.891 -1.819 0.755
37 H15 H H10 N N N 0 -1.385 -2.478 -0.813
38 H12 H H11 N N N 0 -3.18 -1.201 -1.946
39 H13 H H12 N N N 0 -3.866 -2.23 -0.659
40 H1 H H13 N N N 0 -2.779 1.054 -1.702
41 H11 H H14 N N N 0 -3.436 2.565 0.829
42 H10 H H15 N N N 0 -3.521 3.107 -0.873
43 H8 H H16 N N N 0 -5.655 1.963 0.716
44 H9 H H17 N N N 0 -5.71 2.406 -1.014
45 H H H18 N N N 0 -5.272 0.203 -1.719
46 H31 H H19 N N N 0 -2.704 -0.49 1.656
47 H29 H H20 N N N 0 -4.107 0.594 1.823
48 H30 H H21 N N N 0 -4.354 -1.158 1.629
49 H28 H H22 N N N 0 1.16 -1.567 1.931
50 H27 H H23 N N N 0 -0.38 -0.691 2.1
51 H26 H H24 N N N 0 -0.344 -2.279 1.297
52 H4 H H25 N N N 0 3.482 -0.099 -1.045
53 H17 H H26 N N N 0 -0.596 2.161 -1.429
54 H16 H H27 N N N 0 -1.003 2.972 0.104
55 H2 H H28 N N N 0 -0.758 -0.276 -1.598
56 H7 H H29 N N N 0 -7.681 -1.428 -1.13
57 H5 H H30 N N N 0 -6.07 -2.183 -1.102
58 H6 H H31 N N N 0 -7.152 -2.345 0.301
59 H25 H H32 N N N 0 6.267 2.152 0.168