Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : A1ANY

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 61


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N Y N 0 0.399 -3.053 -0.692
2 N3 N N2 N Y N 0 4.228 -1.715 -0.79
3 C4 C C1 N Y N 0 0.729 -1.875 -0.172
4 C5 C C2 N Y N 0 1.308 -3.826 -1.259
5 C6 C C3 N Y N 0 3.006 -2.328 -0.852
6 C7 C C4 N Y N 0 4.111 -0.495 -0.16
7 C8 C C5 N N N 0 5.222 0.449 0.089
8 C10 C C6 N N N 0 6.651 1.612 1.615
9 C13 C C7 N N N 0 5.87 1.05 -0.967
10 C15 C C8 N Y N 0 2.073 -1.47 -0.238
11 C17 C C9 N Y N 0 -2.169 0.77 1.369
12 C20 C C10 N Y N 0 -4.549 0.835 -0.039
13 C21 C C11 N Y N 0 -3.712 -0.268 -0.124
14 C22 C C12 N N N 0 -6.987 2.219 -0.321
15 C24 C C13 N N N 0 -5.049 3.132 0.945
16 O2 O O1 N N N 0 -6.663 -0.416 -0.631
17 S S S1 N N N 0 -6.042 0.813 -0.981
18 O1 O O2 N N N 0 -5.623 1.074 -2.314
19 C19 C C15 N Y N 0 -4.21 1.903 0.76
20 C23 C C14 N N N 0 -6.01 3.399 -0.2
21 C18 C C16 N Y N 0 -3.003 1.863 1.456
22 C16 C C17 N Y N 0 -2.524 -0.306 0.577
23 C3 C C18 S N N 0 -1.622 -1.509 0.479
24 C1 C C19 N N N 0 -1.825 -2.399 1.707
25 C2 C C20 N N N 0 -3.283 -2.858 1.769
26 C C C21 N N N 0 -0.909 -3.62 1.608
27 N N N3 N N N 0 -0.226 -1.068 0.42
28 N2 N N4 N Y N 0 2.576 -3.489 -1.344
29 C14 C C22 N Y N 0 2.817 -0.294 0.199
30 N4 N N5 N N N 0 6.89 1.916 -0.743
31 C12 C C23 N N N 0 7.566 2.545 -1.879
32 C11 C C24 N N N 0 7.287 2.205 0.51
33 O O O3 N N N 0 8.21 2.984 0.688
34 C9 C C25 N N N 0 5.622 0.745 1.412
35 H1 H H1 N N N 0 5.055 -2.084 -1.138
36 H10 H H2 N N N 0 0.996 -4.776 -1.669
37 H12 H H3 N N N 0 6.974 1.847 2.618
38 H16 H H4 N N N 0 5.565 0.831 -1.979
39 H18 H H5 N N N 0 -1.238 0.755 1.915
40 H20 H H6 N N N 0 -3.991 -1.103 -0.749
41 H21 H H7 N N N 0 -7.798 2.476 -1.003
42 H22 H H8 N N N 0 -7.392 1.968 0.659
43 H25 H H9 N N N 0 -4.388 3.992 1.051
44 H26 H H10 N N N 0 -5.625 3.025 1.864
45 H24 H H11 N N N 0 -5.45 3.505 -1.129
46 H23 H H12 N N N 0 -6.568 4.315 -0.002
47 H19 H H13 N N N 0 -2.717 2.702 2.073
48 H H H14 N N N 0 -1.864 -2.072 -0.422
49 H5 H H15 N N N 0 -1.583 -1.835 2.608
50 H8 H H16 N N N 0 -3.524 -3.422 0.868
51 H6 H H17 N N N 0 -3.427 -3.493 2.644
52 H7 H H18 N N N 0 -3.935 -1.988 1.839
53 H4 H H19 N N N 0 0.13 -3.293 1.564
54 H3 H H20 N N N 0 -1.053 -4.254 2.483
55 H2 H H21 N N N 0 -1.15 -4.184 0.707
56 H9 H H22 N N N 0 0.029 -0.211 0.796
57 H17 H H23 N N N 0 2.417 0.569 0.709
58 H14 H H24 N N N 0 7.065 3.48 -2.128
59 H13 H H25 N N N 0 8.605 2.748 -1.617
60 H15 H H26 N N N 0 7.533 1.875 -2.738
61 H11 H H27 N N N 0 5.121 0.285 2.251