Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 4ID

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 51


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N N N 0 2.962 0.685 1.52
2 F1 F F1 N N N 0 -7.552 -2.428 -0.312
3 N1 N N1 N N N 0 1.776 1.329 1.568
4 O1 O O1 N N N 0 3.957 1.178 2.026
5 S1 S S1 N N N 0 -0.868 1.609 1.064
6 C2 C C2 N N N 0 0.676 0.763 0.997
7 F2 F F2 N N N 0 -5.583 -1.994 0.762
8 N2 N N2 N N N 0 -4.283 0.237 -0.504
9 O2 O O2 N N N 0 -3.594 2.026 0.612
10 S2 S S2 N N N 0 4.55 -1.446 0.792
11 C3 C C3 N N N 0 -1.914 0.426 0.18
12 F3 F F3 N N N 0 -5.644 -2.084 -1.52
13 N3 N N3 N N N 0 0.748 -0.409 0.395
14 O3 O O3 N N N 0 5.093 -1.444 2.105
15 C4 C C4 N N N 0 -3.323 0.955 0.112
16 O4 O O4 N N N 0 4.283 -2.637 0.064
17 C5 C C5 N Y N 0 -5.61 0.682 -0.486
18 C6 C C6 N Y N 0 -6.65 -0.235 -0.423
19 C7 C C7 N N N 0 -6.352 -1.712 -0.372
20 C8 C C8 N Y N 0 -7.959 0.207 -0.405
21 C9 C C9 N Y N 0 -8.233 1.561 -0.45
22 C10 C C10 N Y N 0 -7.199 2.477 -0.514
23 C11 C C11 N Y N 0 -5.888 2.042 -0.526
24 C12 C C12 N N N 0 1.894 -1.081 0.322
25 C13 C C13 N N N 0 3.027 -0.565 0.882
26 C14 C C14 N Y N 0 5.648 -0.491 -0.202
27 C15 C C15 N Y N 0 6.79 0.052 0.356
28 C16 C C16 N Y N 0 7.651 0.802 -0.424
29 C17 C C17 N Y N 0 7.369 1.008 -1.762
30 C18 C C18 N N N 0 8.308 1.826 -2.612
31 C19 C C19 N Y N 0 6.227 0.464 -2.32
32 C20 C C20 N Y N 0 5.369 -0.289 -1.541
33 C21 C C21 N N N 0 4.127 -0.886 -2.151
34 HN1 H HN1 N N N 0 1.707 2.191 2.007
35 HN2 H HN2 N N N 0 -4.054 -0.588 -0.961
36 H3 H H3 N N N 0 -1.529 0.285 -0.83
37 H3A H H3A N N N 0 -1.908 -0.528 0.707
38 H8 H H8 N N N 0 -8.768 -0.506 -0.356
39 H9 H H9 N N N 0 -9.257 1.905 -0.437
40 H10 H H10 N N N 0 -7.416 3.535 -0.55
41 H11 H H11 N N N 0 -5.081 2.758 -0.571
42 H12 H H12 N N N 0 1.926 -2.038 -0.176
43 H15 H H15 N N N 0 7.01 -0.109 1.401
44 H16 H H16 N N N 0 8.543 1.226 0.012
45 H18 H H18 N N N 0 9.057 1.172 -3.058
46 H18A H H18A N N N 0 7.743 2.323 -3.4
47 H18B H H18B N N N 0 8.801 2.574 -1.991
48 H19 H H19 N N N 0 6.008 0.625 -3.365
49 H21 H H21 N N N 0 3.302 -0.179 -2.06
50 H21A H H21A N N N 0 4.306 -1.101 -3.204
51 H21B H H21B N N N 0 3.874 -1.809 -1.629