Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 8QW

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 66


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 -2.002 0.224 0.671
2 C2 C C2 N Y N 0 0.097 -0.265 1.705
3 C4 C C3 N Y N 0 0.708 0.649 0.819
4 C6 C C4 N Y N 0 -0.047 1.308 -0.107
5 C12 C C5 N Y N 0 -5.889 0.569 -0.803
6 C13 C C6 N Y N 0 -6.835 -1.259 0.427
7 C14 C C7 N Y N 0 -5.731 -0.531 0.028
8 C15 C C8 N Y N 0 -8.099 -0.896 0.0
9 C16 C C9 N Y N 0 -7.163 0.934 -1.233
10 F40 F F1 N N N 0 11.357 -3.249 -1.918
11 C36 C C10 N Y N 0 10.7 -2.254 -1.283
12 C38 C C11 N Y N 0 10.862 -2.076 0.08
13 C37 C C12 N Y N 0 10.19 -1.058 0.728
14 C34 C C13 N Y N 0 9.867 -1.408 -1.997
15 C35 C C14 N Y N 0 9.196 -0.391 -1.346
16 C26 C C15 N Y N 0 9.355 -0.217 0.016
17 C25 C C16 R N N 0 8.621 0.892 0.724
18 C39 C C17 N N N 0 9.032 2.239 0.125
19 C24 C C18 N N N 0 7.136 0.7 0.557
20 O33 O O1 N N N 0 6.714 -0.245 -0.075
21 N23 N N1 N N N 0 6.276 1.579 1.11
22 C10 C C22 N Y N 0 2.169 0.893 0.895
23 C20 C C19 N Y N 0 4.898 1.349 1.038
24 C22 C C20 N Y N 0 4.078 1.71 2.1
25 C21 C C21 N Y N 0 2.72 1.484 2.031
26 C19 C C23 N Y N 0 2.994 0.532 -0.169
27 C18 C C24 N Y N 0 4.351 0.764 -0.098
28 N5 N N2 N Y N 0 -1.386 1.097 -0.179
29 C3 C C25 N Y N 0 -1.245 -0.474 1.63
30 N8 N N3 N Y N 0 -3.298 0.222 0.374
31 C9 C C26 N Y N 0 -3.527 1.062 -0.632
32 N7 N N4 N Y N 0 -2.392 1.62 -1.004
33 N11 N N5 N N N 0 -4.772 1.312 -1.204
34 O31 O O2 N N N 0 -7.324 2.011 -2.049
35 O28 O O4 N N N 0 -8.982 -3.127 0.776
36 C32 C C27 N N N 0 -8.659 2.327 -2.45
37 C17 C C28 N Y N 0 -8.264 0.199 -0.829
38 S27 S S1 N N N 0 -9.502 -1.831 0.511
39 C30 C C29 N N N 0 -10.041 -1.034 2.049
40 O29 O O3 N N N 0 -10.457 -1.622 -0.52
41 H1 H H1 N N N 0 0.689 -0.789 2.44
42 H2 H H2 N N N 0 0.423 2.006 -0.784
43 H3 H H3 N N N 0 -6.711 -2.116 1.074
44 H4 H H4 N N N 0 -4.745 -0.817 0.363
45 H5 H H5 N N N 0 11.514 -2.734 0.637
46 H6 H H6 N N N 0 10.316 -0.919 1.792
47 H7 H H7 N N N 0 9.743 -1.544 -3.061
48 H8 H H8 N N N 0 8.546 0.269 -1.902
49 H9 H H9 N N N 0 8.873 0.875 1.785
50 H10 H H10 N N N 0 8.502 3.042 0.637
51 H11 H H11 N N N 0 10.106 2.378 0.246
52 H12 H H12 N N N 0 8.781 2.256 -0.936
53 H13 H H13 N N N 0 6.613 2.371 1.558
54 H14 H H14 N N N 0 4.505 2.168 2.98
55 H15 H H15 N N N 0 2.083 1.765 2.857
56 H16 H H16 N N N 0 2.57 0.073 -1.05
57 H17 H H17 N N N 0 4.99 0.484 -0.922
58 H18 H H18 N N N 0 -1.725 -1.17 2.302
59 H19 H H19 N N N 0 -4.866 2.001 -1.88
60 H20 H H20 N N N 0 -9.085 1.482 -2.992
61 H21 H H21 N N N 0 -9.264 2.535 -1.567
62 H22 H H22 N N N 0 -8.646 3.204 -3.096
63 H23 H H23 N N N 0 -9.253 0.48 -1.161
64 H24 H H24 N N N 0 -10.296 0.006 1.849
65 H25 H H25 N N N 0 -10.915 -1.554 2.441
66 H26 H H26 N N N 0 -9.234 -1.077 2.782