Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 4GR

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 C13 C C1 N N N 0 1.943 -0.931 -0.13
2 C18 C C2 N Y N 0 5.633 2.318 -0.452
3 C17 C C3 N Y N 0 4.379 1.968 0.074
4 C16 C C4 N N N 0 3.783 0.661 -0.24
5 C15 C C5 N N N 0 2.536 0.369 0.183
6 C19 C C6 N Y N 0 6.185 3.553 -0.149
7 C20 C C7 N Y N 0 5.503 4.435 0.667
8 C21 C C8 N Y N 0 4.265 4.095 1.189
9 C22 C C9 N Y N 0 3.7 2.871 0.899
10 C24 C C10 N Y N 0 2.874 -2.978 1.683
11 C11 C C11 N Y N 0 2.019 -3.761 0.93
12 C34 C C12 N Y N 0 6.884 1.677 -2.478
13 C27 C C13 N Y N 0 3.897 -4.932 0.017
14 C33 C C14 N Y N 0 -5.667 -0.976 1.0
15 CL1 CL CL1 N N N 0 3.422 5.215 2.213
16 CL2 CL CL2 N N N 0 -4.947 -3.867 -0.266
17 C3 C C15 N Y N 0 -1.403 -2.4 -0.027
18 N4 N N1 N Y N 0 -2.244 -3.388 -0.174
19 C5 C C16 N Y N 0 -3.498 -2.922 -0.119
20 C6 C C17 N Y N 0 -3.435 -1.575 0.072
21 N7 N N2 N Y N 0 -2.097 -1.252 0.135
22 C8 C C18 N Y N 0 -4.577 -0.644 0.193
23 C9 C C19 S N N 0 0.099 -2.521 -0.03
24 C10 C C20 N N N 0 0.53 -3.549 1.017
25 N12 N N3 N N N 0 0.695 -1.221 0.288
26 O14 O O1 N N N 0 2.575 -1.75 -0.771
27 N23 N N4 N Y N 0 6.325 1.422 -1.274
28 C25 C C21 N Y N 0 4.24 -3.172 1.603
29 C26 C C22 N Y N 0 4.752 -4.15 0.77
30 C28 C C23 N Y N 0 2.531 -4.738 0.097
31 C29 C C24 N Y N 0 -4.568 0.568 -0.499
32 C30 C C25 N Y N 0 -5.635 1.434 -0.384
33 C31 C C26 N Y N 0 -6.718 1.1 0.421
34 C32 C C27 N Y N 0 -6.73 -0.106 1.111
35 N35 N N5 N Y N 0 7.423 0.562 -2.898
36 N36 N N6 N Y N 0 7.242 -0.379 -2.044
37 N37 N N7 N Y N 0 6.587 0.063 -1.025
38 N38 N N8 N N N 0 -7.799 1.982 0.536
39 C39 C C28 N N N 0 -8.184 2.719 -0.525
40 O40 O O2 N N N 0 -7.543 2.679 -1.557
41 O41 O O3 N N N 0 -9.277 3.5 -0.441
42 C42 C C29 N N N 0 -9.632 4.266 -1.622
43 H49 H H1 N N N 0 4.345 -0.065 -0.809
44 H48 H H2 N N N 0 1.974 1.096 0.752
45 H50 H H3 N N N 0 7.149 3.826 -0.552
46 H51 H H4 N N N 0 5.938 5.396 0.9
47 H52 H H5 N N N 0 2.735 2.61 1.307
48 H53 H H6 N N N 0 2.474 -2.212 2.331
49 H62 H H7 N N N 0 6.883 2.624 -2.997
50 H56 H H8 N N N 0 4.297 -5.696 -0.634
51 H61 H H9 N N N 0 -5.679 -1.915 1.533
52 H43 H H11 N N N 0 -1.724 -0.367 0.268
53 H44 H H12 N N N 0 0.435 -2.843 -1.016
54 H45 H H13 N N N 0 0.017 -4.493 0.832
55 H46 H H14 N N N 0 0.272 -3.185 2.012
56 H47 H H15 N N N 0 0.19 -0.568 0.799
57 H54 H H16 N N N 0 4.908 -2.56 2.191
58 H55 H H17 N N N 0 5.819 -4.301 0.708
59 H57 H H18 N N N 0 1.863 -5.35 -0.492
60 H58 H H19 N N N 0 -3.726 0.828 -1.123
61 H59 H H20 N N N 0 -5.628 2.372 -0.919
62 H60 H H21 N N N 0 -7.574 -0.362 1.734
63 H63 H H22 N N N 0 -8.271 2.062 1.379
64 H64 H H23 N N N 0 -10.53 4.851 -1.42
65 H66 H H24 N N N 0 -8.813 4.937 -1.88
66 H65 H H25 N N N 0 -9.821 3.586 -2.453