Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 21B

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 41


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C16 C C16 N N N 0 5.116 2.334 -1.111
2 N N N N N N 0 4.354 1.444 -0.225
3 C15 C C15 N N N 0 2.936 1.826 -0.187
4 C14 C C14 N N N 0 2.177 0.879 0.744
5 C13 C C13 N N N 0 0.722 1.271 0.782
6 C4 C C4 N N N 0 -0.223 0.359 0.528
7 C3 C C3 N Y N 0 0.161 -1.063 0.39
8 C17 C C17 N Y N 0 1.07 -1.552 1.342
9 C18 C C18 N Y N 0 1.466 -2.869 1.327
10 C C C N Y N 0 0.953 -3.719 0.363
11 C5 C C5 N Y N 0 -1.632 0.793 0.396
12 C10 C C10 N Y N 0 -2.31 1.389 1.456
13 C9 C C9 N Y N 0 -3.623 1.782 1.274
14 C8 C C8 N Y N 0 -4.242 1.581 0.053
15 C7 C C7 N Y N 0 -3.561 0.985 -0.994
16 C6 C C6 N Y N 0 -2.246 0.586 -0.814
17 C11 C C11 N N N 0 -1.503 -0.079 -1.932
18 C12 C C12 N N N 0 -1.289 -1.551 -1.71
19 C2 C C2 N Y N 0 -0.338 -1.902 -0.586
20 C1 C C1 N Y N 0 0.067 -3.241 -0.575
21 H1 H H1 N N N 0 6.162 2.029 -1.12
22 H6 H H6 N N N 0 2.845 2.848 0.181
23 H2 H H2 N N N 0 4.711 2.274 -2.121
24 H3 H H3 N N N 0 5.04 3.36 -0.749
25 H4 H H4 N N N 0 4.462 0.48 -0.501
26 H7 H H7 N N N 0 2.516 1.763 -1.191
27 H8 H H8 N N N 0 2.269 -0.143 0.376
28 H9 H H9 N N N 0 2.597 0.942 1.748
29 H10 H H10 N N N 0 0.443 2.288 1.014
30 H11 H H11 N N N 0 1.463 -0.886 2.095
31 H12 H H12 N N N 0 2.171 -3.236 2.059
32 H13 H H13 N N N 0 1.247 -4.758 0.347
33 H17 H H17 N N N 0 -4.051 0.832 -1.944
34 H14 H H14 N N N 0 -1.818 1.541 2.405
35 H15 H H15 N N N 0 -4.166 2.245 2.085
36 H16 H H16 N N N 0 -5.267 1.892 -0.085
37 H18 H H18 N N N 0 -2.065 0.058 -2.856
38 H19 H H19 N N N 0 -0.531 0.402 -2.04
39 H20 H H20 N N N 0 -2.256 -2.007 -1.496
40 H21 H H21 N N N 0 -0.906 -1.986 -2.633
41 H22 H H22 N N N 0 -0.325 -3.916 -1.321