Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : JWR

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 37


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N Y N 0 0.166 0.438 -0.716
2 C11 C C2 N Y N 0 0.419 -0.651 -1.575
3 C13 C C3 N Y N 0 1.21 0.998 -0.009
4 C17 C C4 N Y N 0 4.618 -0.03 -0.099
5 C19 C C5 N Y N 0 6.055 0.018 0.268
6 C20 C C6 N Y N 0 6.95 -0.891 -0.291
7 C21 C C7 N Y N 0 8.286 -0.842 0.054
8 C22 C C8 N Y N 0 8.736 0.108 0.953
9 C23 C C9 N Y N 0 7.852 1.013 1.511
10 C24 C C10 N Y N 0 6.515 0.976 1.168
11 C25 C C11 N N N 0 -2.132 0.141 -0.2
12 C1 C C12 N Y N 0 -3.521 0.654 -0.171
13 C2 C C13 N Y N 0 -4.582 -0.167 0.228
14 C3 C C14 N Y N 0 -5.864 0.357 0.246
15 N4 N N1 N Y N 0 -6.089 1.607 -0.107
16 C5 C C15 N Y N 0 -5.116 2.412 -0.49
17 C6 C C16 N Y N 0 -3.809 1.973 -0.536
18 CL7 CL CL1 N N N 0 -7.192 -0.646 0.738
19 CL8 CL CL2 N N N 0 -4.295 -1.814 0.693
20 N9 N N2 N N N 0 -1.125 0.948 -0.588
21 C12 C C17 N Y N 0 1.671 -1.139 -1.7
22 C14 C C18 N Y N 0 2.501 0.467 -0.163
23 N15 N N3 N Y N 0 2.705 -0.591 -1.006
24 N16 N N4 N Y N 0 4.075 -0.887 -0.943
25 N18 N N5 N Y N 0 3.675 0.786 0.371
26 O26 O O1 N N N 0 -1.901 -1.007 0.125
27 H30 H H1 N N N 0 -0.391 -1.097 -2.133
28 H32 H H2 N N N 0 1.037 1.833 0.653
29 H33 H H3 N N N 0 6.6 -1.634 -0.993
30 H34 H H4 N N N 0 8.981 -1.547 -0.379
31 H35 H H5 N N N 0 9.782 0.143 1.22
32 H36 H H6 N N N 0 8.208 1.753 2.212
33 H37 H H7 N N N 0 5.826 1.687 1.601
34 H27 H H10 N N N 0 -5.347 3.429 -0.77
35 H28 H H11 N N N 0 -3.018 2.639 -0.85
36 H29 H H14 N N N 0 -1.298 1.883 -0.777
37 H31 H H15 N N N 0 1.855 -1.974 -2.36