Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : CIT

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 21


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 0.412 -0.006 2.479
2 O1 O O1 N N N 0 -0.446 0.836 2.368
3 O2 O O2 N N N 0 0.812 -0.4 3.698
4 C2 C C2 N N N 0 1.032 -0.616 1.249
5 C3 C C3 N N N 0 0.402 0.002 0.0
6 O7 O O7 N N N 0 0.631 1.412 0.0
7 C4 C C4 N N N 0 1.032 -0.616 -1.249
8 C5 C C5 N N N 0 0.412 -0.006 -2.479
9 O3 O O3 N N N 0 -0.446 0.836 -2.368
10 O4 O O4 N N N 0 0.812 -0.4 -3.698
11 C6 C C6 N N N 0 -1.08 -0.265 0.0
12 O5 O O5 N N N 0 -1.86 0.656 0.0
13 O6 O O6 N N N 0 -1.533 -1.529 0.0
14 HO2 H HO2 N N N 0 0.414 -0.009 4.488
15 H21 H 1H2 N N N 0 2.105 -0.422 1.249
16 H22 H 2H2 N N N 0 0.858 -1.692 1.249
17 HO7 H HO7 N N N 0 1.59 1.54 0.0
18 H41 H 1H4 N N N 0 2.105 -0.422 -1.249
19 H42 H 2H4 N N N 0 0.858 -1.692 -1.249
20 HO4 H HO4 N N N 0 0.414 -0.009 -4.488
21 HO6 H HO6 N N N 0 -2.485 -1.701 0.0