Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : ESZ

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 44


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 BR2 BR BR1 N N N 0 -4.271 0.923 -0.562
2 C8 C C1 R N N 0 -3.115 0.03 0.753
3 C7 C C2 R N N 0 -2.648 -1.342 0.206
4 O1 O O1 N N N 0 -3.115 -2.396 1.049
5 C5 C C3 S N N 0 -1.125 -1.285 0.227
6 C6 C C4 N N N 0 -0.612 -1.739 1.595
7 C4 C C5 N N N 0 -0.398 -2.042 -0.865
8 C3 C C6 N N N 0 1.114 -1.833 -0.651
9 C2 C C7 S N N 0 1.457 -0.35 -0.652
10 C12 C C8 R N N 0 0.642 0.416 0.399
11 C10 C C9 S N N 0 -0.82 0.227 0.032
12 C9 C C10 N N N 0 -1.829 0.869 0.989
13 C21 C C11 N Y N 0 2.924 -0.121 -0.434
14 C20 C C12 N Y N 0 3.819 -1.04 -0.965
15 C19 C C13 N Y N 0 5.178 -0.872 -0.804
16 C18 C C14 N Y N 0 5.655 0.228 -0.105
17 O3 O O2 N N N 0 6.992 0.407 0.055
18 C17 C C15 N Y N 0 4.762 1.142 0.428
19 C16 C C16 N Y N 0 3.394 0.97 0.268
20 C15 C C17 N N N 0 2.484 1.997 0.888
21 C14 C C18 N N N 0 1.057 1.886 0.333
22 H1 H H1 N N N 0 -3.652 -0.105 1.692
23 H2 H H2 N N N 0 -3.008 -1.485 -0.812
24 H3 H H3 N N N 0 -4.079 -2.455 1.108
25 H4 H H4 N N N 0 -0.917 -2.771 1.773
26 H5 H H5 N N N 0 0.475 -1.674 1.616
27 H6 H H6 N N N 0 -1.03 -1.098 2.371
28 H7 H H7 N N N 0 -0.637 -3.103 -0.802
29 H8 H H8 N N N 0 -0.691 -1.655 -1.841
30 H9 H H9 N N N 0 1.405 -2.268 0.305
31 H10 H H10 N N N 0 1.662 -2.328 -1.453
32 H11 H H11 N N N 0 1.207 0.056 -1.632
33 H12 H H12 N N N 0 0.839 0.006 1.389
34 H13 H H13 N N N 0 -1.002 0.557 -0.991
35 H14 H H14 N N N 0 -1.991 1.916 0.734
36 H15 H H15 N N N 0 -1.497 0.77 2.023
37 H16 H H16 N N N 0 3.447 -1.896 -1.509
38 H17 H H17 N N N 0 5.867 -1.592 -1.219
39 H18 H H18 N N N 0 7.352 -0.005 0.852
40 H19 H H19 N N N 0 5.134 1.997 0.975
41 H20 H H20 N N N 0 2.461 1.849 1.967
42 H21 H H21 N N N 0 2.872 2.993 0.673
43 H22 H H22 N N N 0 1.036 2.233 -0.7
44 H23 H H23 N N N 0 0.379 2.488 0.938