Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : AKF

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 52


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N N N 0 -4.519 2.645 0.41
2 N12 N N1 N N N 0 -1.093 -1.099 0.134
3 C13 C C2 N N N 0 -0.426 -2.4 0.04
4 C15 C C3 N N N 0 -0.784 -3.247 1.263
5 C17 C C4 N Y N 0 1.92 -3.222 -0.098
6 C21 C C5 N Y N 0 3.711 0.302 0.007
7 C22 C C6 N Y N 0 5.103 0.238 -0.06
8 C28 C C7 N Y N 0 3.077 1.542 0.095
9 C02 C C8 N N N 0 -2.438 -1.035 0.192
10 C04 C C9 S N N 0 -4.502 0.155 0.338
11 C05 C C10 N N N 0 -5.074 0.226 -1.081
12 C07 C C11 N N N 0 -7.038 1.401 -0.29
13 C08 C C12 N N N 0 -6.523 1.363 1.151
14 C09 C C13 N N N 0 -4.989 1.375 1.13
15 C11 C C14 N N N 0 -5.09 2.648 -1.011
16 C14 C C15 N N N 0 -0.886 -3.119 -1.23
17 C16 C C16 N Y N 0 1.066 -2.197 -0.011
18 C19 C C17 N Y N 0 2.909 -0.94 -0.023
19 C23 C C18 N Y N 0 5.848 1.404 -0.033
20 C25 C C19 N Y N 0 5.209 2.635 0.061
21 C27 C C20 N Y N 0 3.828 2.7 0.122
22 F26 F F1 N N N 0 5.938 3.772 0.088
23 N06 N N2 N N N 0 -5.896 1.437 -1.214
24 N20 N N3 N Y N 0 1.609 -1.002 0.028
25 O01 O O1 N N N 0 -3.097 -2.055 0.167
26 O03 O O2 N N N 0 -3.051 0.161 0.279
27 O24 O O3 N N N 0 7.205 1.345 -0.097
28 S18 S S1 N Y N 0 3.559 -2.574 -0.133
29 H1 H H1 N N N 0 -4.876 3.523 0.949
30 H2 H H2 N N N 0 -3.43 2.661 0.367
31 H3 H H3 N N N 0 -0.567 -0.285 0.154
32 H4 H H4 N N N 0 -1.863 -3.394 1.3
33 H5 H H5 N N N 0 -0.288 -4.214 1.194
34 H6 H H6 N N N 0 -0.456 -2.734 2.168
35 H7 H H7 N N N 0 1.652 -4.268 -0.136
36 H8 H H8 N N N 0 5.598 -0.719 -0.133
37 H9 H H9 N N N 0 1.999 1.596 0.143
38 H10 H H10 N N N 0 -4.846 -0.758 0.824
39 H11 H H11 N N N 0 -4.256 0.261 -1.801
40 H12 H H12 N N N 0 -5.688 -0.654 -1.27
41 H13 H H13 N N N 0 -7.636 0.511 -0.486
42 H14 H H14 N N N 0 -7.651 2.291 -0.434
43 H15 H H15 N N N 0 -6.887 2.237 1.692
44 H16 H H16 N N N 0 -6.877 0.457 1.642
45 H17 H H17 N N N 0 -4.588 1.348 2.143
46 H18 H H18 N N N 0 -5.716 3.529 -1.149
47 H19 H H19 N N N 0 -4.272 2.666 -1.731
48 H20 H H20 N N N 0 -0.631 -2.516 -2.101
49 H21 H H21 N N N 0 -0.39 -4.087 -1.299
50 H22 H H22 N N N 0 -1.966 -3.266 -1.193
51 H23 H H23 N N N 0 3.336 3.659 0.195
52 H25 H H25 N N N 0 7.557 1.374 -0.997