Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 0TA

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 41


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N N N 0 5.044 -0.391 0.0070
2 N3 N N3 N N N 0 0.555 0.923 0.072
3 C4 C C4 N N N 0 0.975 2.326 0.125
4 C5 C C5 N N N 0 0.26 3.046 1.281
5 C6 C C6 N N N 0 -0.567 4.185 0.648
6 C7 C C7 N N N 0 -0.792 3.723 -0.813
7 C8 C C8 N N N 0 0.558 3.051 -1.171
8 C10 C C10 N N N 0 -1.192 -0.777 0.0080
9 C13 C C13 N Y N 0 -2.638 -1.111 -0.0040
10 C15 C C15 N Y N 0 -3.319 -1.783 0.97
11 O O O N N N 0 -1.586 1.512 0.096
12 C9 C C9 N N N 0 -0.757 0.619 0.061
13 N5 N N5 N Y N 0 -4.606 -1.877 0.577
14 N4 N N4 N Y N 0 -4.73 -1.25 -0.669
15 C14 C C14 N Y N 0 -3.56 -0.785 -1.018
16 C11 C C11 N N N 0 -0.255 -1.772 -0.031
17 C12 C C12 N Y N 0 1.116 -1.423 -0.029
18 C1 C C1 N Y N 0 2.116 -2.406 -0.073
19 C C C N N N 0 1.757 -3.868 -0.124
20 C3 C C3 N Y N 0 1.503 -0.068 0.028
21 N2 N N2 N Y N 0 2.799 0.226 0.038
22 C2 C C2 N Y N 0 3.707 -0.737 -0.0050
23 N N N N Y N 0 3.379 -2.023 -0.059
24 H5 H H5 N N N 0 5.303 0.543 0.046
25 H4 H H4 N N N 0 5.724 -1.082 -0.02
26 H6 H H6 N N N 0 2.055 2.388 0.257
27 H8 H H8 N N N 0 -0.399 2.352 1.803
28 H7 H H7 N N N 0 0.993 3.458 1.975
29 H9 H H9 N N N 0 -1.52 4.296 1.164
30 H10 H H10 N N N 0 -0.0090 5.121 0.673
31 H12 H H12 N N N 0 -1.608 3.003 -0.869
32 H11 H H11 N N N 0 -0.986 4.576 -1.462
33 H13 H H13 N N N 0 1.298 3.804 -1.442
34 H14 H H14 N N N 0 0.424 2.336 -1.983
35 H17 H H17 N N N 0 -2.902 -2.17 1.888
36 H H H N N N 0 -5.322 -2.306 1.071
37 H16 H H16 N N N 0 -3.336 -0.251 -1.93
38 H15 H H15 N N N 0 -0.557 -2.809 -0.07
39 H2 H H2 N N N 0 1.662 -4.184 -1.163
40 H1 H H1 N N N 0 2.538 -4.452 0.363
41 H3 H H3 N N N 0 0.81 -4.028 0.392