Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 4IO

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 43


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 -5.231 -0.074 -1.064
2 C13 C C2 N Y N 0 -4.068 -2.393 -0.109
3 C17 C C3 N Y N 0 -3.8 -1.183 0.503
4 C20 C C4 N Y N 0 -2.696 3.31 -0.709
5 C21 C C5 N Y N 0 -1.462 3.547 -1.181
6 C22 C C6 N Y N 0 -0.606 2.457 -0.703
7 C02 C C7 N N N 0 2.684 0.668 -0.407
8 C03 C C8 N Y N 0 1.257 1.006 -0.253
9 C04 C C9 N Y N 0 0.417 0.173 0.501
10 C05 C C10 N Y N 0 -0.905 0.471 0.652
11 C06 C C11 N Y N 0 -1.439 1.612 0.056
12 C09 C C12 N Y N 0 -4.378 -0.022 0.022
13 C11 C C13 N Y N 0 -5.506 -1.286 -1.67
14 C12 C C14 N Y N 0 -4.925 -2.445 -1.192
15 C23 C C15 N Y N 0 0.743 2.151 -0.857
16 N07 N N1 N Y N 0 -2.699 2.159 0.032
17 N14 N N2 N N N 1 -3.445 -3.634 0.403
18 O01 O O1 N N N 0 3.412 1.389 -1.06
19 O15 O O2 N N N 0 -3.688 -4.702 -0.13
20 O16 O O3 N N N -1 -2.689 -3.588 1.357
21 O18 O O4 N N N 0 -5.115 2.382 0.486
22 O19 O O5 N N N 0 -3.621 1.225 2.122
23 S08 S S1 N N N 0 -4.025 1.523 0.793
24 H101 H H1 N N N 0 -5.685 0.832 -1.438
25 H171 H H2 N N N 0 -3.13 -1.141 1.349
26 H201 H H3 N N N 0 -3.557 3.937 -0.883
27 H211 H H4 N N N 0 -1.159 4.381 -1.797
28 H041 H H6 N N N 0 0.822 -0.713 0.967
29 H051 H H7 N N N 0 -1.54 -0.179 1.235
30 H111 H H8 N N N 0 -6.176 -1.327 -2.516
31 H121 H H9 N N N 0 -5.134 -3.391 -1.67
32 H231 H H10 N N N 0 1.386 2.795 -1.438
33 O1 O O6 N N Y 0 3.182 -0.44 0.178
34 C2 C C16 N Y Y 0 4.479 -0.748 -0.087
35 C3 C C17 N Y Y 0 4.793 -1.759 -0.984
36 N1 N N3 N Y Y 0 6.049 -2.062 -1.244
37 C5 C C18 N Y Y 0 7.05 -1.424 -0.671
38 C6 C C19 N Y Y 0 6.817 -0.403 0.234
39 C7 C C20 N Y Y 0 5.51 -0.05 0.532
40 CL1 CL CL1 N N Y 0 8.145 0.428 0.981
41 H2 H H11 N N Y 0 3.999 -2.304 -1.473
42 H3 H H12 N N Y 0 8.066 -1.702 -0.911
43 H4 H H13 N N Y 0 5.298 0.743 1.235