Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : Q85

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 34


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 O1 O O1 N N N 0 -6.664 -0.476 -0.279
2 C1 C C1 N N N 0 -7.319 -0.706 0.97
3 O2 O O2 N N N 0 1.367 1.451 0.006
4 C2 C C2 N Y N 0 -5.376 -0.045 -0.231
5 C3 C C3 N Y N 0 -4.68 0.198 -1.406
6 C4 C C4 N Y N 0 -3.371 0.636 -1.354
7 C8 C C8 N Y N 0 1.812 -0.842 -0.029
8 C5 C C5 N Y N 0 -2.754 0.832 -0.132
9 C6 C C6 N N N 0 -1.324 1.304 -0.079
10 C7 C C7 N N N 0 0.907 0.327 -0.032
11 C9 C C9 N Y N 0 1.288 -2.135 -0.079
12 C10 C C10 N Y N 0 2.138 -3.221 -0.082
13 C11 C C11 N Y N 0 3.508 -3.032 -0.036
14 C12 C C12 N Y N 0 4.034 -1.753 0.013
15 C13 C C13 N Y N 0 3.195 -0.658 0.017
16 N1 N N1 N N N 0 -0.427 0.146 -0.076
17 SE1 SE SE1 N N N 0 3.944 1.152 0.078
18 C14 C C14 N Y N 0 -3.446 0.59 1.041
19 C15 C C15 N Y N 0 -4.757 0.158 0.994
20 H1 H H1 N N N 0 -6.776 -1.468 1.53
21 H2 H H2 N N N 0 -7.341 0.22 1.545
22 H3 H H3 N N N 0 -8.338 -1.046 0.789
23 H4 H H4 N N N 0 -5.161 0.045 -2.361
24 H5 H H5 N N N 0 -2.829 0.826 -2.269
25 H6 H H6 N N N 0 -1.113 1.925 -0.949
26 H7 H H7 N N N 0 -1.168 1.887 0.829
27 H8 H H8 N N N 0 0.219 -2.284 -0.114
28 H11 H H11 N N N 0 5.104 -1.612 0.049
29 H9 H H9 N N N 0 1.734 -4.222 -0.12
30 H10 H H10 N N N 0 4.169 -3.886 -0.038
31 H12 H H12 N N N 0 -0.794 -0.752 -0.107
32 H13 H H13 N N N 0 4.011 1.394 1.618
33 H14 H H14 N N N 0 -2.962 0.744 1.994
34 H15 H H15 N N N 0 -5.297 -0.031 1.911