Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 60B

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 C4 C C1 N Y N 0 3.578 -1.469 -0.334
2 C5 C C2 N Y N 0 2.239 -1.112 -0.488
3 C11 C C3 N N N 0 7.012 -0.473 0.425
4 C7 C C4 N Y N 0 2.717 1.104 -0.011
5 C8 C C5 N Y N 0 4.064 0.834 0.169
6 C9 C C6 N Y N 0 4.512 -0.47 0.006
7 C12 C C7 N N N 0 7.379 0.538 -0.663
8 C13 C C8 N N N 0 6.896 0.245 1.771
9 N3 N N1 N Y N 0 4.267 -2.635 -0.431
10 C1 C C9 N N N 0 6.601 -3.476 -0.202
11 C2 C C10 N Y N 0 5.526 -2.42 -0.187
12 N6 N N2 N Y N 0 1.86 0.139 -0.324
13 N10 N N3 N Y N 0 5.73 -1.102 0.095
14 N14 N N4 N N N 0 2.251 2.408 0.149
15 C15 C C11 N Y N 0 0.891 2.671 0.087
16 C16 C C12 N Y N 0 0.421 3.986 0.129
17 C17 C C13 N Y N 0 -0.943 4.202 0.065
18 N18 N N5 N Y N 0 -1.759 3.164 -0.034
19 C19 C C14 N Y N 0 -1.286 1.925 -0.072
20 N20 N N6 N Y N 0 0.016 1.677 -0.018
21 C21 C C15 N Y N 0 -2.234 0.792 -0.182
22 C22 C C16 N Y N 0 -1.897 -0.576 -0.227
23 N23 N N7 N Y N 0 -3.003 -1.263 -0.326
24 N24 N N8 N Y N 0 -4.082 -0.37 -0.347
25 C25 C C17 N Y N 0 -3.595 0.882 -0.252
26 S26 S S1 N N N 0 -5.681 -0.783 -0.461
27 O27 O O1 N N N 0 -6.296 0.354 -1.051
28 O28 O O2 N N N 0 -5.672 -2.039 -1.127
29 C29 C C18 N N N 0 -6.222 -0.979 1.259
30 C30 C C19 N N N 0 -7.648 -1.481 1.498
31 C31 C C20 N N N 0 -6.457 -2.403 1.768
32 H1 H H1 N N N 0 1.508 -1.865 -0.744
33 H2 H H2 N N N 0 7.786 -1.238 0.487
34 H3 H H3 N N N 0 4.754 1.624 0.424
35 H4 H H4 N N N 0 8.373 0.94 -0.464
36 H5 H H5 N N N 0 7.374 0.044 -1.634
37 H6 H H6 N N N 0 6.653 1.35 -0.664
38 H7 H H7 N N N 0 6.634 -0.475 2.546
39 H8 H H8 N N N 0 7.849 0.713 2.017
40 H9 H H9 N N N 0 6.121 1.01 1.709
41 H10 H H10 N N N 0 6.964 -3.61 -1.22
42 H11 H H11 N N N 0 7.425 -3.164 0.44
43 H12 H H12 N N N 0 6.191 -4.417 0.165
44 H13 H H13 N N N 0 2.878 3.131 0.304
45 H14 H H14 N N N 0 1.108 4.815 0.21
46 H15 H H15 N N N 0 -1.338 5.206 0.095
47 H16 H H16 N N N 0 -0.898 -0.985 -0.188
48 H17 H H17 N N N 0 -4.176 1.792 -0.237
49 H18 H H18 N N N 0 -5.819 -0.252 1.964
50 H19 H H19 N N N 0 -8.182 -1.084 2.362
51 H20 H H20 N N N 0 -8.26 -1.693 0.622
52 H21 H H21 N N N 0 -6.286 -3.222 1.069
53 H22 H H22 N N N 0 -6.208 -2.613 2.808