Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : R4V

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 49


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N3 N N1 N Y N 0 -1.354 0.441 -0.089
2 C4 C C1 S N N 0 2.51 1.402 0.76
3 N2 N N2 N Y N 0 -3.492 1.015 -0.762
4 C7 C C2 N Y N 0 -0.864 1.585 -0.554
5 C6 C C3 N N N 0 0.716 3.039 0.442
6 C9 C C4 N Y N 0 -3.073 2.175 -1.248
7 C13 C C5 N Y N 0 -5.095 -2.477 0.638
8 C8 C C6 N Y N 0 -1.732 2.5 -1.158
9 N5 N N3 N Y N 0 -6.631 -1.152 -0.289
10 C18 C C7 N N N 0 5.557 -2.374 -0.573
11 C16 C C8 S N N 0 5.341 -0.863 -0.469
12 C1 C C9 N N N 0 1.302 1.719 3.057
13 C2 C C10 R N N 0 2.479 2.059 2.141
14 C3 C C11 R N N 0 2.185 2.903 0.899
15 C5 C C12 N N N 0 1.211 0.757 0.231
16 N1 N N4 N N N 0 0.489 1.868 -0.442
17 C10 C C13 N Y N 0 -2.647 0.168 -0.195
18 N4 N N5 N N N 0 -3.125 -1.034 0.3
19 C11 C C14 N Y N 0 -4.496 -1.342 0.198
20 C12 C C15 N Y N 0 -5.483 -0.53 -0.379
21 N6 N N6 N Y N 0 -6.419 -2.381 0.347
22 C14 C C16 N N N 0 -7.441 -3.388 0.641
23 F1 F F1 N N N 0 -1.271 3.674 -1.643
24 N7 N N7 N N N 0 3.786 0.936 0.21
25 C15 C C17 N N N 0 4.029 -0.384 0.096
26 O1 O O1 N N N 0 3.191 -1.188 0.448
27 C17 C C18 N N N 0 5.314 -1.548 -1.837
28 F2 F F2 N N N 0 6.851 -2.859 -0.356
29 F3 F F3 N N N 0 4.52 -3.206 -0.136
30 H9 H H1 N N N 0 0.046 3.003 1.301
31 H10 H H2 N N N 0 0.575 3.968 -0.11
32 H11 H H3 N N N 0 -3.77 2.859 -1.708
33 H14 H H4 N N N 0 -4.607 -3.308 1.127
34 H2 H H10 N N N 0 2.892 3.675 0.594
35 H3 H H5 N N N 0 6.208 -0.246 -0.232
36 H5 H H6 N N N 0 1.356 0.669 3.343
37 H6 H H7 N N N 0 1.345 2.342 3.95
38 H4 H H8 N N N 0 0.366 1.904 2.53
39 H1 H H9 N N N 0 3.433 2.219 2.643
40 H8 H H11 N N N 0 1.442 -0.033 -0.483
41 H7 H H12 N N N 0 0.618 0.364 1.056
42 H12 H H13 N N N 0 -2.517 -1.663 0.717
43 H13 H H14 N N N 0 -5.324 0.442 -0.821
44 H16 H H15 N N N 0 -7.864 -3.2 1.628
45 H15 H H16 N N N 0 -8.231 -3.334 -0.108
46 H17 H H17 N N N 0 -6.99 -4.38 0.623
47 H18 H H18 N N N 0 4.456 1.579 -0.071
48 H19 H H19 N N N 0 6.163 -1.381 -2.5
49 H20 H H20 N N N 0 4.347 -1.651 -2.329