Chemical Components in the PDB

pdbe.org/chem
spacer

PDBeChem : Atoms of Molecule

 Molecule : 0GS

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 BR1 BR BR1 N N N 0 6.246 -2.193 -0.735
2 C10 C C10 N N N 0 2.026 -0.027 1.717
3 C13 C C13 S N N 0 1.056 0.399 0.613
4 C15 C C15 S N N 0 -0.375 0.11 1.056
5 C17 C C17 R N N 0 -1.345 0.286 -0.109
6 C19 C C19 N N N 0 -1.462 1.769 -0.472
7 C2 C C2 N Y N 0 5.379 -0.761 0.144
8 C23 C C23 N N N 0 1.225 1.895 0.338
9 C3 C C3 N Y N 0 6.047 0.44 0.342
10 C30 C C30 N N N 0 -3.44 -0.628 -0.907
11 C33 C C33 N Y N 0 -4.787 -1.146 -0.474
12 C34 C C34 N Y N 0 -5.857 -0.278 -0.356
13 C36 C C36 N Y N 0 -7.092 -0.754 0.041
14 C37 C C37 N Y N 0 -7.258 -2.098 0.321
15 C39 C C39 N Y N 0 -6.189 -2.965 0.204
16 C4 C C4 N Y N 0 5.406 1.491 0.988
17 C41 C C41 N Y N 0 -4.955 -2.491 -0.199
18 C43 C C43 N N N 0 -8.258 0.192 0.169
19 C46 C C46 N N N 0 -8.303 0.756 1.59
20 C5 C C5 N Y N 0 4.105 1.336 1.432
21 C7 C C7 N Y N 0 3.443 0.138 1.233
22 C8 C C8 N Y N 0 4.077 -0.906 0.586
23 F44 F F44 N N N 0 -8.109 1.242 -0.744
24 F45 F F45 N N N 0 -9.447 -0.494 -0.098
25 F52 F F52 N N N 0 6.052 2.661 1.184
26 H1 H H1 N N N 0 3.606 2.151 1.934
27 H10 H H10 N N N 0 0.944 2.464 1.224
28 H11 H H11 N N N 0 2.264 2.102 0.084
29 H12 H H12 N N N 0 -3.172 0.454 0.824
30 H14 H H14 N N N 0 -3.575 0.232 -1.563
31 H15 H H15 N N N 0 -2.904 -1.412 -1.442
32 H16 H H16 N N N 0 -5.727 0.771 -0.575
33 H17 H H17 N N N 0 -8.224 -2.469 0.632
34 H18 H H18 N N N 0 -6.319 -4.015 0.423
35 H19 H H19 N N N 0 -4.12 -3.17 -0.295
36 H2 H H2 N N N 0 3.555 -1.839 0.428
37 H20 H H20 N N N 0 -7.376 1.291 1.799
38 H21 H H21 N N N 0 -9.146 1.441 1.683
39 H22 H H22 N N N 0 -8.419 -0.061 2.302
40 H23 H H23 N N N 0 -1.339 -1.49 1.837
41 H24 H H24 N N N 0 7.81 -0.141 -0.558
42 H25 H H25 N N N 0 7.829 1.432 0.031
43 H3 H H3 N N N 0 1.849 -1.071 1.973
44 H4 H H4 N N N 0 1.868 0.595 2.598
45 H5 H H5 N N N 0 1.274 -0.163 -0.296
46 H6 H H6 N N N 0 -0.648 0.796 1.857
47 H7 H H7 N N N 0 -0.979 -0.269 -0.972
48 H8 H H8 N N N 0 -2.202 1.892 -1.262
49 H9 H H9 N N N 0 -1.766 2.337 0.407
50 N28 N N28 N N N 0 -2.667 -0.225 0.276
51 N53 N N53 N N N 0 7.363 0.593 -0.108
52 O26 O O26 N N N 0 0.111 3.783 -1.136
53 O27 O O27 N N N 0 0.532 1.611 -2.195
54 O50 O O50 N N N 0 -0.457 -1.233 1.537
55 S22 S S22 N N N 0 0.153 2.365 -1.052