Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 49T

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 29


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 S N N 0 -0.047 1.302 0.05
2 C2 C C2 R N N 0 0.46 -0.142 0.083
3 N2 N N2 N N N 0 1.819 -0.196 -0.463
4 C7 C C7 N N N 0 2.876 0.056 0.333
5 O7 O O7 N N N 0 2.703 0.329 1.503
6 C8 C C8 N N N 0 4.273 0.001 -0.229
7 O5 O O5 N N N 0 -1.393 1.344 0.53
8 C5 C C5 R N N 0 -2.314 0.579 -0.25
9 C6 C C6 N N N 0 -3.72 0.72 0.337
10 C4 C C4 R N N 0 -1.898 -0.894 -0.229
11 O4 O O4 N N N 0 -1.953 -1.387 1.111
12 C3 C C3 R N N 0 -0.467 -1.02 -0.762
13 O3 O O3 N N N 0 -0.044 -2.382 -0.678
14 O1 O O1 N N Y 0 -0.004 1.792 -1.291
15 H1 H H1 N N N 0 0.585 1.924 0.685
16 H2 H H2 N N N 0 0.467 -0.502 1.112
17 HN2 H H3 N N N 0 1.957 -0.414 -1.398
18 H81 H H4 N N N 0 4.553 0.985 -0.605
19 H82 H H5 N N N 0 4.968 -0.3 0.555
20 H83 H H6 N N N 0 4.308 -0.723 -1.043
21 H5 H H7 N N N 0 -2.31 0.943 -1.277
22 H61 H H8 N N N 0 -4.016 1.769 0.323
23 H62 H H9 N N N 0 -4.422 0.137 -0.258
24 H63 H H10 N N N 0 -3.723 0.355 1.364
25 H4 H H11 N N N 0 -2.573 -1.473 -0.859
26 HO4 H H12 N N Y 0 -2.83 -1.333 1.514
27 H3 H H13 N N N 0 -0.435 -0.69 -1.801
28 HO3 H H14 N N Y 0 -0.591 -2.997 -1.186
29 HO1 H H15 N N Y 0 -0.312 2.704 -1.387