Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : BG0

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 C01 C C1 N N N 0 -3.028 3.051 -2.569
2 O02 O O1 N N N 0 -3.419 1.806 -1.986
3 C03 C C2 N Y N 0 -2.485 1.149 -1.247
4 C04 C C3 N Y N 0 -1.22 1.691 -1.087
5 C05 C C4 N Y N 0 -0.271 1.022 -0.336
6 C06 C C5 R N N 0 1.104 1.613 -0.163
7 C07 C C6 N N N 0 1.367 1.844 1.298
8 C08 C C7 N N N 0 0.762 2.965 1.951
9 N09 N N1 N N N 0 0.282 3.855 2.47
10 C10 C C8 N N N 0 2.164 1.012 2.01
11 N11 N N2 N N N 0 2.371 1.266 3.343
12 O12 O O2 N N N 0 2.758 -0.055 1.45
13 C13 C C9 N Y N 0 2.904 -0.118 0.103
14 C14 C C10 N Y N 0 3.847 -0.987 -0.442
15 N15 N N3 N N N 0 4.633 -1.787 0.401
16 C16 C C11 N Y N 0 4.007 -1.062 -1.822
17 N17 N N4 N N N 0 4.954 -1.935 -2.373
18 C18 C C12 N Y N 0 3.227 -0.269 -2.651
19 C19 C C13 N Y N 0 2.293 0.591 -2.106
20 C20 C C14 N Y N 0 2.129 0.669 -0.734
21 C21 C C15 N Y N 0 -0.581 -0.187 0.257
22 C22 C C16 N Y N 0 -1.842 -0.734 0.101
23 BR BR BR1 N N N 0 -2.265 -2.385 0.92
24 C24 C C17 N Y N 0 -2.8 -0.065 -0.646
25 O25 O O3 N N N 0 -4.041 -0.601 -0.8
26 C26 C C18 N N N 0 -5.025 -0.248 0.174
27 H1 H H1 N N N 0 -2.736 3.745 -1.781
28 H2 H H2 N N N 0 -2.185 2.888 -3.24
29 H3 H H3 N N N 0 -3.864 3.468 -3.13
30 H5 H H5 N N N 0 1.158 2.564 -0.694
31 H8 H H8 N N N 0 1.948 2.032 3.762
32 H9 H H9 N N N 0 2.939 0.679 3.866
33 H11 H H11 N N N 0 4.521 -1.735 1.363
34 H12 H H12 N N N 0 5.289 -2.392 0.022
35 H13 H H13 N N N 0 5.498 -2.489 -1.792
36 H14 H H14 N N N 0 5.064 -1.986 -3.336
37 H15 H H15 N N N 0 3.349 -0.324 -3.723
38 H16 H H16 N N N 0 1.687 1.207 -2.755
39 H17 H H17 N N N 0 0.163 -0.707 0.842
40 H18 H H18 N N N 0 -4.689 -0.566 1.161
41 H19 H H19 N N N 0 -5.17 0.832 0.169
42 H20 H H20 N N N 0 -5.967 -0.742 -0.066
43 H7 H H7 N N N 0 -0.974 2.636 -1.55