Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KH6

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 55


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C5 C C1 N N N 0 1.538 -0.938 -0.115
2 C7 C C2 N Y N 0 -1.074 -1.139 1.485
3 C8 C C3 N Y N 0 -1.807 -0.89 -0.828
4 C10 C C4 N Y N 0 -0.811 -1.225 0.044
5 N12 N N1 N Y N 0 3.116 -2.502 -1.327
6 C15 C C5 N Y N 0 5.089 -1.677 -0.784
7 C26 C C6 N N N 0 5.521 2.359 1.217
8 C28 C C7 N N N 0 5.599 2.592 -1.671
9 C1 C C8 N Y N 0 4.099 -0.896 -0.165
10 C2 C C9 N Y N 0 2.864 -1.434 -0.525
11 C3 C C10 N Y N 0 -3.056 -0.471 -0.328
12 N4 N N2 N Y N 0 -3.274 -0.394 1.024
13 N6 N N3 N Y N 0 -4.167 -0.097 -0.949
14 C9 C C11 N N N 0 4.324 0.28 0.701
15 C11 C C12 N Y N 0 -5.101 0.215 -0.035
16 N13 N N4 N Y N 0 4.503 -2.627 -1.465
17 C14 C C13 N Y N 0 -2.302 -0.728 1.916
18 C16 C C14 N Y N 0 -4.563 0.042 1.203
19 N17 N N5 N N N 0 0.43 -1.641 -0.425
20 N18 N N6 N N N 0 5.18 1.246 0.317
21 C19 C C15 N N N 0 -0.055 -1.489 2.429
22 N20 N N7 N N N 0 0.753 -1.766 3.178
23 O21 O O1 N N N 0 1.443 0.102 0.507
24 O22 O O2 N N N 0 3.736 0.375 1.761
25 C23 C C16 N Y N 0 -6.48 0.679 -0.325
26 O24 O O3 N N N 0 6.053 3.612 -0.779
27 C25 C C17 N N N 0 2.109 -3.375 -1.937
28 C27 C C18 N N N 0 5.802 1.221 -1.017
29 C29 C C19 N N N 0 5.331 3.675 0.454
30 C30 C C20 N Y N 0 -6.906 0.824 -1.644
31 C31 C C21 N Y N 0 -7.356 0.966 0.72
32 C32 C C22 N Y N 0 -8.189 1.256 -1.908
33 C33 C C23 N Y N 0 -8.637 1.397 0.445
34 C34 C C24 N Y N 0 -9.053 1.545 -0.866
35 H1 H H1 N N N 0 -1.638 -0.944 -1.893
36 H2 H H2 N N N 0 6.155 -1.523 -0.706
37 H3 H H3 N N N 0 4.864 2.342 2.087
38 H4 H H4 N N N 0 6.558 2.267 1.539
39 H5 H H5 N N N 0 4.54 2.74 -1.885
40 H6 H H6 N N N 0 6.168 2.641 -2.6
41 H7 H H7 N N N 0 -2.503 -0.666 2.976
42 H8 H H8 N N N 0 -5.058 0.212 2.147
43 H9 H H9 N N N 0 0.499 -2.436 -0.976
44 H10 H H10 N N N 0 1.796 -4.128 -1.214
45 H11 H H11 N N N 0 1.247 -2.78 -2.239
46 H12 H H12 N N N 0 2.536 -3.866 -2.811
47 H13 H H13 N N N 0 5.332 0.449 -1.626
48 H14 H H14 N N N 0 6.868 1.014 -0.921
49 H15 H H15 N N N 0 4.272 3.827 0.248
50 H16 H H16 N N N 0 5.708 4.502 1.055
51 H17 H H17 N N N 0 -6.232 0.599 -2.457
52 H18 H H18 N N N 0 -7.032 0.85 1.744
53 H19 H H19 N N N 0 -8.521 1.37 -2.93
54 H20 H H20 N N N 0 -9.317 1.62 1.254
55 H21 H H21 N N N 0 -10.057 1.883 -1.078