Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : E2R

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 C1 C C13 N N N 0 -0.668 -0.288 1.441
2 C10 C C6 N Y N 0 2.129 0.866 -0.782
3 C11 C C15 N Y N 0 1.438 0.092 0.149
4 C12 C C17 N Y N 0 1.923 -1.15 0.521
5 C13 C C7 N Y N 0 3.101 -1.623 -0.032
6 C14 C C18 N Y N 0 3.79 -0.856 -0.953
7 C15 C C8 N Y N 0 3.307 0.385 -1.329
8 C17 C C9 N N N 0 -3.402 -0.703 -1.238
9 C18 C C19 N N N 0 -2.479 0.017 -0.253
10 C19 C C14 N N N 0 -1.591 -1.008 0.455
11 C20 C C10 N N N 0 -2.469 -2.005 1.214
12 C21 C C11 N N N 0 -3.392 -2.725 0.229
13 C22 C C12 N N N 0 -4.28 -1.7 -0.479
14 C3 C C16 N Y N 0 -0.039 1.952 0.526
15 C4 C C1 N Y N 0 -1.027 2.566 1.275
16 C5 C C2 N Y N 0 -1.294 3.912 1.091
17 C6 C C3 N Y N 0 -0.574 4.639 0.163
18 C7 C C4 N Y N 0 0.414 4.029 -0.589
19 C8 C C5 N Y N 0 0.687 2.682 -0.414
20 CL1 CL CL1 N N N 0 3.713 -3.18 0.433
21 H1 H H1 N N N 0 -1.586 1.997 2.004
22 H13 H H13 N N N 0 -0.092 -1.023 2.003
23 H10 H H10 N N N 0 -2.791 -3.257 -0.509
24 H11 H H11 N N N 0 -4.017 -3.436 0.77
25 H12 H H12 N N N 0 -4.88 -1.168 0.259
26 H14 H H14 N N N 0 -1.266 0.309 2.129
27 H15 H H15 N N N 0 -0.991 -1.54 -0.282
28 H16 H H16 N N N 0 1.383 -1.747 1.241
29 H18 H H18 N N N 0 -5.756 -3.056 -0.948
30 H17 H H17 N N N 0 4.709 -1.228 -1.382
31 H2 H H2 N N N 0 -2.065 4.394 1.674
32 H20 H H20 N N N 0 -5.718 -1.731 -1.952
33 H21 H H21 N N N 0 -1.854 0.728 -0.794
34 H22 H H22 N N N 0 -3.08 0.549 0.485
35 H3 H H3 N N N 0 -0.785 5.689 0.023
36 H4 H H4 N N N 0 0.973 4.602 -1.314
37 H5 H H5 N N N 0 3.849 0.979 -2.049
38 H6 H H6 N N N 0 -2.802 -1.235 -1.976
39 H7 H H7 N N N 0 -4.035 0.027 -1.743
40 H8 H H8 N N N 0 -3.069 -1.473 1.952
41 H9 H H9 N N N 0 -1.836 -2.735 1.719
42 N2 N N1 N N N 0 0.246 0.588 0.703
43 N23 N N2 N N N 0 -5.166 -2.391 -1.425
44 O9 O O1 N N N 0 1.654 2.083 -1.154