Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : MJ4

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 27


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N N N 0 -1.331 -0.104 0.095
2 C4 C C1 N N N 0 -0.341 -0.489 1.11
3 C5 C C2 N Y N 0 1.034 -0.075 0.653
4 C6 C C3 N Y N 0 3.339 0.206 -0.294
5 C7 C C4 N Y N 0 2.879 1.257 0.386
6 C8 C C5 N Y N 0 1.607 1.102 0.91
7 C1 C C6 N N N 0 -5.099 -0.482 -0.142
8 C2 C C7 R N N 0 -3.688 -0.077 -0.572
9 C3 C C8 N N N 0 -2.686 -0.493 0.508
10 O1 O O1 N N N 0 -3.633 1.339 -0.751
11 S1 S S1 N Y N 0 2.13 -1.071 -0.295
12 C9 C C9 N N N 0 4.689 0.125 -0.959
13 H1 H H1 N N N 0 -1.283 0.884 -0.101
14 H3 H H3 N N N 0 -0.576 0.007 2.053
15 H4 H H4 N N N 0 -0.367 -1.569 1.252
16 H5 H H5 N N N 0 3.455 2.162 0.517
17 H6 H H6 N N N 0 1.117 1.875 1.483
18 H7 H H7 N N N 0 -5.812 -0.186 -0.911
19 H8 H H8 N N N 0 -5.141 -1.563 -0.004
20 H9 H H9 N N N 0 -5.349 0.013 0.796
21 H10 H H10 N N N 0 -3.437 -0.573 -1.51
22 H11 H H11 N N N 0 -2.728 -1.574 0.645
23 H12 H H12 N N N 0 -2.937 0.002 1.446
24 H13 H H13 N N N 0 -4.243 1.674 -1.423
25 H14 H H14 N N N 0 4.8 -0.848 -1.438
26 H15 H H15 N N N 0 4.774 0.911 -1.709
27 H16 H H16 N N N 0 5.471 0.252 -0.209