Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : J6Q

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 39


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 3.789 -1.606 -2.111
2 C2 C C2 N Y N 0 2.967 -1.07 -0.967
3 C3 C C3 N Y N 0 1.957 -0.158 -1.21
4 C5 C C4 N Y N 0 1.458 -0.087 1.131
5 C6 C C5 N Y N 0 2.463 -1.003 1.374
6 C7 C C6 N Y N 0 3.219 -1.495 0.325
7 C11 C C7 N N N 0 0.282 2.542 0.487
8 C12 C C8 N N N 0 1.559 3.256 0.129
9 C15 C C9 N Y N 0 -1.233 0.686 -0.152
10 C16 C C10 N Y N 0 -1.582 0.358 1.152
11 C23 C C11 N Y N 0 -3.33 -0.16 -0.938
12 C24 C C12 N Y N 0 -2.087 0.437 -1.186
13 C4 C C13 N Y N 0 1.203 0.333 -0.161
14 CL8 CL CL1 N N N 0 4.483 -2.646 0.629
15 C9 C C14 S N N 0 0.102 1.328 -0.426
16 O13 O O1 N N N 0 2.255 2.837 -0.765
17 O14 O O2 N N N 0 1.924 4.358 0.803
18 C17 C C15 N Y N 0 -2.8 -0.224 1.423
19 C18 C C16 N Y N 0 -3.685 -0.486 0.383
20 N19 N N1 N Y N 0 -4.94 -1.041 0.315
21 C20 C C17 N N N 0 -5.738 -1.545 1.435
22 N21 N N2 N Y N 0 -5.308 -1.029 -1.039
23 N22 N N3 N Y N 0 -4.358 -0.511 -1.736
24 H27 H H1 N N N 0 3.317 -2.504 -2.509
25 H25 H H2 N N N 0 3.855 -0.852 -2.895
26 H26 H H3 N N N 0 4.791 -1.849 -1.756
27 H28 H H4 N N N 0 1.758 0.17 -2.219
28 H29 H H5 N N N 0 0.867 0.296 1.95
29 H30 H H6 N N N 0 2.659 -1.335 2.383
30 H32 H H7 N N N 0 0.329 2.212 1.525
31 H31 H H8 N N N 0 -0.562 3.221 0.36
32 H33 H H9 N N N 0 -0.893 0.562 1.959
33 H38 H H10 N N N 0 -1.806 0.701 -2.194
34 H10 H H11 N N N 0 0.144 1.648 -1.467
35 H1 H H12 N N N 0 2.752 4.781 0.538
36 H34 H H13 N N N 0 -3.068 -0.473 2.439
37 H36 H H14 N N N 0 -6.354 -0.739 1.834
38 H35 H H15 N N N 0 -6.38 -2.355 1.089
39 H37 H H16 N N N 0 -5.075 -1.916 2.216