Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : IJU

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 18


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C4 C C1 N Y N 0 -0.523 0.089 -0.003
2 C5 C C2 N Y N 0 0.765 -0.428 0.0
3 C6 C C3 N Y N 0 0.923 -1.806 0.003
4 C7 C C4 N Y N 0 -0.199 -2.613 0.002
5 N1 N N1 N Y N 0 -1.408 -2.086 -0.001
6 C3 C C5 N Y N 0 -1.597 -0.781 -0.004
7 C1 C C6 N N N 0 -4.238 1.821 0.003
8 O1 O O1 N N N 0 -2.952 1.197 0.001
9 C2 C C7 N N N 0 -3.0 -0.231 -0.002
10 BR1 BR BR1 N N N 0 2.268 0.72 0.0
11 H1 H H1 N N N 0 -0.684 1.157 -0.001
12 H2 H H2 N N N 0 1.911 -2.243 0.005
13 H3 H H3 N N N 0 -0.084 -3.687 0.004
14 H4 H H4 N N N 0 -4.115 2.904 0.004
15 H5 H H5 N N N 0 -4.79 1.519 -0.887
16 H6 H H6 N N N 0 -4.788 1.516 0.893
17 H7 H H7 N N N 0 -3.526 -0.576 -0.892
18 H8 H H8 N N N 0 -3.525 -0.579 0.888