Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : C0Q

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 56


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N Y N 0 -3.373 -0.232 0.069
2 C2 C C2 N Y N 0 -3.519 1.09 -0.315
3 C3 C C3 N Y N 0 -2.396 1.859 -0.543
4 C7 C C4 N N N 0 -0.687 -2.592 0.906
5 C8 C C5 N N N 0 -0.022 -3.03 -0.401
6 C9 C C6 N N N 0 2.173 -2.082 -0.604
7 C10 C C7 R N N 0 3.132 -1.699 0.526
8 C11 C C8 N N N 0 4.139 -2.837 0.728
9 C12 C C9 N N N 0 5.616 -1.776 -0.897
10 C13 C C10 N N N 0 4.604 -0.639 -1.076
11 C14 C C11 N Y N 0 3.142 0.69 0.253
12 C15 C C12 N Y N 0 3.252 2.951 0.748
13 C16 C C13 N Y N 0 1.955 3.096 0.31
14 C19 C C14 N N N 0 -5.898 0.641 -0.936
15 C20 C C15 N N N 0 -5.719 -0.629 -0.157
16 O2 O O1 N N N 0 -6.692 -1.301 0.113
17 N N N1 N N N 0 -4.506 -1.04 0.248
18 C C C16 N N N 0 -4.363 -2.352 0.885
19 C18 C C17 N N N 0 -4.89 1.69 -0.497
20 C4 C C18 N Y N 0 -1.118 1.329 -0.34
21 N5 N N2 N N N 0 -0.047 2.201 -0.574
22 C17 C C19 N Y N 0 1.25 1.954 -0.11
23 N2 N N5 N N N 0 3.856 -0.473 0.167
24 CL CL CL1 N N N 0 1.204 4.661 0.277
25 N3 N N3 N Y N 0 3.804 1.752 0.708
26 N4 N N4 N Y N 0 1.866 0.785 -0.107
27 N1 N N6 N N N 0 4.926 -3.006 -0.499
28 O1 O O2 N N N 0 1.383 -3.197 -0.185
29 O O O3 N N N 0 -1.985 -2.073 0.642
30 C6 C C20 N Y N 0 -2.103 -0.772 0.272
31 C5 C C21 N Y N 0 -0.979 0.017 0.071
32 H4 H H1 N N N 0 -2.505 2.878 -0.881
33 H6 H H2 N N N 0 -0.768 -3.449 1.575
34 H7 H H3 N N N 0 -0.079 -1.822 1.38
35 H9 H H4 N N N 0 -0.455 -3.975 -0.73
36 H8 H H5 N N N 0 -0.185 -2.269 -1.164
37 H11 H H6 N N N 0 1.522 -1.238 -0.832
38 H10 H H7 N N N 0 2.744 -2.353 -1.492
39 H H H8 N N N 0 2.57 -1.538 1.441
40 H13 H H9 N N N 0 4.804 -2.592 1.557
41 H12 H H10 N N N 0 3.605 -3.761 0.95
42 H16 H H11 N N N 0 6.141 -1.943 -1.837
43 H15 H H12 N N N 0 6.335 -1.499 -0.126
44 H17 H H13 N N N 0 5.132 0.286 -1.31
45 H18 H H14 N N N 0 3.918 -0.885 -1.886
46 H19 H H15 N N N 0 3.807 3.801 1.115
47 H23 H H16 N N N 0 -5.762 0.434 -1.997
48 H24 H H17 N N N 0 -6.905 1.024 -0.771
49 H1 H H18 N N N 0 -3.874 -2.235 1.852
50 H3 H H19 N N N 0 -5.348 -2.795 1.027
51 H2 H H20 N N N 0 -3.761 -3.001 0.249
52 H21 H H21 N N N 0 -5.217 2.127 0.447
53 H22 H H22 N N N 0 -4.839 2.474 -1.253
54 H20 H H23 N N N 0 -0.212 3.013 -1.08
55 H25 H H24 N N N 0 4.352 -3.357 -1.251
56 H5 H H26 N N N 0 0.005 -0.396 0.235