Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 9FS

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 53


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C14 C C1 N Y N 0 -2.299 1.911 -0.149
2 C5 C C2 N Y N 0 1.117 -0.745 -0.037
3 C6 C C3 N Y N 0 0.243 0.285 -0.035
4 C11 C C4 N Y N 0 -4.708 0.632 0.023
5 C7 C C5 N Y N 0 -1.058 -0.253 -0.052
6 C9 C C6 N Y N 0 -2.324 0.523 -0.057
7 C10 C C7 N Y N 0 -3.557 -0.132 0.031
8 C12 C C8 N Y N 0 -4.604 2.016 -0.076
9 C3 C C9 N N N 0 0.48 -4.006 1.177
10 C1 C C10 N N N 0 0.503 -3.983 -1.321
11 C2 C C11 N N N 0 0.964 -3.249 -0.061
12 N4 N N1 N Y N 0 0.407 -1.894 -0.054
13 N8 N N2 N Y N 0 -0.954 -1.565 -0.063
14 N13 N N3 N Y N 0 -3.421 2.605 -0.154
15 N15 N N4 N N N 0 -5.758 2.791 -0.096
16 C16 C C12 N N N 0 -6.06 -0.027 0.11
17 F17 F F1 N N N 0 -6.735 0.439 1.243
18 F18 F F2 N N N 0 -6.804 0.28 -1.035
19 F19 F F3 N N N 0 -5.898 -1.414 0.202
20 C20 C C13 N N N 0 2.62 -0.632 -0.027
21 C21 C C14 R N N 0 3.244 0.538 -0.789
22 C22 C C15 S N N 0 3.235 0.531 0.753
23 C23 C C16 N N N 0 4.72 0.428 1.162
24 N24 N N5 N N N 0 5.468 0.967 -0.003
25 C25 C C17 N N N 0 4.724 0.424 -1.214
26 C26 C C18 N N N 0 6.86 0.498 0.003
27 C27 C C19 N N N 0 7.709 1.087 1.145
28 O28 O O1 N N N 0 8.733 1.256 0.145
29 C29 C C20 N N N 0 7.785 1.286 -0.944
30 H1 H H1 N N N 0 -1.352 2.426 -0.213
31 H2 H H2 N N N 0 0.498 1.335 -0.023
32 H3 H H3 N N N 0 -3.608 -1.208 0.104
33 H4 H H4 N N N 0 -0.609 -4.061 1.166
34 H5 H H5 N N N 0 0.894 -5.014 1.171
35 H6 H H6 N N N 0 0.809 -3.483 2.075
36 H7 H H7 N N N 0 -0.586 -4.038 -1.332
37 H8 H H8 N N N 0 0.848 -3.443 -2.203
38 H9 H H9 N N N 0 0.917 -4.991 -1.327
39 H10 H H10 N N N 0 2.053 -3.194 -0.051
40 H11 H H11 N N N 0 -6.628 2.366 -0.04
41 H12 H H12 N N N 0 -5.693 3.756 -0.165
42 H13 H H13 N N N 0 3.162 -1.578 -0.028
43 H14 H H14 N N N 0 2.603 1.208 -1.364
44 H15 H H15 N N N 0 2.588 1.195 1.327
45 H16 H H16 N N N 0 4.909 1.035 2.048
46 H17 H H17 N N N 0 4.997 -0.61 1.345
47 H19 H H19 N N N 0 5.004 -0.613 -1.4
48 H20 H H20 N N N 0 4.928 1.037 -2.092
49 H21 H H21 N N N 0 6.946 -0.584 -0.098
50 H22 H H22 N N N 0 7.323 2.025 1.544
51 H23 H H23 N N N 0 7.963 0.366 1.922
52 H24 H H24 N N N 0 8.103 0.724 -1.822
53 H25 H H25 N N N 0 7.421 2.285 -1.184