Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : BKW

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 45


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 OP3 O O1 N N N 0 5.177 -2.838 0.534
2 CZ C C1 N N N 0 4.874 -1.532 0.463
3 OP2 O O2 N N N 0 5.469 -0.815 -0.307
4 C34 C C2 N N N 0 3.793 -0.959 1.343
5 C29 C C3 N Y N 0 3.652 0.516 1.07
6 C30 C C4 N Y N 0 4.24 1.435 1.918
7 C31 C C5 N Y N 0 4.114 2.789 1.665
8 C32 C C6 N Y N 0 3.401 3.222 0.563
9 C33 C C7 N Y N 0 2.814 2.303 -0.286
10 C28 C C8 N Y N 0 2.939 0.95 -0.032
11 S1 S S1 N N N 0 2.196 -0.222 -1.118
12 OS1 O O3 N N N 0 2.351 0.294 -2.433
13 OS2 O O4 N N N 0 2.679 -1.499 -0.722
14 C1 C C9 N Y N 0 0.466 -0.22 -0.783
15 C6 C C10 N Y N 0 -0.382 0.566 -1.544
16 C5 C C11 N Y N 0 -1.738 0.572 -1.286
17 C4 C C12 N Y N 0 -2.252 -0.215 -0.258
18 C7 C C15 N Y N 0 -3.709 -0.213 0.024
19 C3 C C13 N Y N 0 -1.394 -1.005 0.505
20 C2 C C14 N Y N 0 -0.04 -1.007 0.235
21 C12 C C16 N Y N 0 -4.222 -1.0 1.053
22 C11 C C17 N Y N 0 -5.577 -0.996 1.313
23 C10 C C18 N Y N 0 -6.429 -0.208 0.551
24 O13 O O5 N N N 0 -7.762 -0.205 0.809
25 C14 C C19 N N N 0 -8.581 0.628 -0.014
26 C9 C C20 N Y N 0 -5.92 0.578 -0.475
27 C8 C C21 N Y N 0 -4.566 0.582 -0.735
28 H1 H H1 N N N 0 5.877 -3.159 -0.05
29 H2 H H2 N N N 0 2.849 -1.46 1.131
30 H3 H H3 N N N 0 4.058 -1.111 2.389
31 H4 H H4 N N N 0 4.797 1.096 2.779
32 H5 H H5 N N N 0 4.573 3.507 2.328
33 H6 H H6 N N N 0 3.303 4.279 0.365
34 H7 H H7 N N N 0 2.257 2.641 -1.147
35 H8 H H8 N N N 0 0.018 1.175 -2.341
36 H9 H H9 N N N 0 -2.399 1.186 -1.88
37 H10 H H10 N N N 0 -1.787 -1.617 1.303
38 H11 H H11 N N N 0 0.626 -1.621 0.823
39 H12 H H12 N N N 0 -3.56 -1.614 1.646
40 H13 H H13 N N N 0 -5.975 -1.606 2.11
41 H14 H H14 N N N 0 -8.261 1.665 0.088
42 H15 H H15 N N N 0 -8.485 0.319 -1.054
43 H16 H H16 N N N 0 -9.622 0.537 0.298
44 H17 H H17 N N N 0 -6.585 1.19 -1.066
45 H18 H H18 N N N 0 -4.171 1.193 -1.533