Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : QA0

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 53


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 0.286 -3.907 0.516
2 C20 C C2 N Y N 0 1.845 -0.168 -1.799
3 C21 C C3 N Y N 0 3.179 -0.497 -1.642
4 C22 C C4 N Y N 0 3.996 0.283 -0.848
5 C24 C C5 N Y N 0 4.348 2.245 0.65
6 C26 C C6 N Y N 0 4.643 4.144 2.088
7 C28 C C7 N Y N 0 6.499 2.701 1.612
8 C02 C C8 N Y N 0 -4.807 2.891 -0.044
9 C03 C C9 N Y N 0 -4.771 2.152 1.126
10 C04 C C10 N Y N 0 -3.948 1.049 1.224
11 C05 C C11 N Y N 0 -3.151 0.68 0.141
12 C06 C C12 N Y N 0 -2.264 -0.505 0.24
13 C07 C C13 N Y N 0 -2.229 -1.25 1.42
14 C08 C C14 N Y N 0 -1.401 -2.359 1.518
15 C09 C C15 N N N 0 -1.364 -3.149 2.767
16 C12 C C16 N Y N 0 -0.596 -2.731 0.421
17 C16 C C17 N Y N 0 -0.638 -1.977 -0.759
18 C23 C C18 N Y N 0 3.474 1.403 -0.205
19 C25 C C19 N Y N 0 3.826 3.365 1.294
20 C27 C C20 N Y N 0 5.977 3.816 2.244
21 C29 C C21 N Y N 0 5.691 1.915 0.816
22 C30 C C22 N Y N 0 2.129 1.73 -0.366
23 C31 C C23 N Y N 0 1.323 0.946 -1.167
24 C33 C C24 N Y N 0 -1.476 -0.872 -0.845
25 C34 C C25 N Y N 0 -3.191 1.427 -1.035
26 C35 C C26 N Y N 0 -4.018 2.528 -1.122
27 N17 N N1 N N N 0 0.152 -2.337 -1.843
28 O10 O O1 N N N 0 -0.639 -4.119 2.851
29 O11 O O2 N N N 0 -2.134 -2.792 3.813
30 O14 O O3 N N N 0 -0.126 -5.003 0.193
31 O15 O O4 N N N 0 1.552 -3.765 0.957
32 O19 O O5 N N N 0 -0.27 -0.338 -3.227
33 O32 O O6 N N N 0 1.666 -1.838 -3.727
34 S18 S S1 N N N 0 0.808 -1.167 -2.814
35 CL01 CL CL1 N N N 0 -5.85 4.274 -0.162
36 H211 H H1 N N N 0 3.582 -1.365 -2.141
37 H221 H H2 N N N 0 5.038 0.025 -0.726
38 H261 H H3 N N N 0 4.24 5.013 2.587
39 H281 H H4 N N N 0 7.541 2.447 1.741
40 H031 H H5 N N N 0 -5.389 2.439 1.964
41 H041 H H6 N N N 0 -3.92 0.474 2.137
42 H071 H H7 N N N 0 -2.847 -0.962 2.258
43 H251 H H8 N N N 0 2.784 3.623 1.172
44 H271 H H9 N N N 0 6.613 4.428 2.866
45 H291 H H10 N N N 0 6.1 1.045 0.323
46 H301 H H11 N N N 0 1.72 2.597 0.131
47 H311 H H12 N N N 0 0.28 1.199 -1.293
48 H331 H H13 N N N 0 -1.512 -0.294 -1.757
49 H341 H H14 N N N 0 -2.576 1.145 -1.877
50 H351 H H15 N N N 0 -4.049 3.108 -2.033
51 H171 H H16 N N N 0 0.319 -3.274 -2.031
52 H1 H H17 N N N 0 -2.076 -3.339 4.609
53 H2 H H18 N N N 0 2.094 -4.565 0.998