Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 1O5

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 50


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 O3 O O3 N N N 0 5.565 -1.733 1.175
2 S S S N N N 0 5.795 -0.436 0.643
3 O2 O O2 N N N 0 6.287 0.647 1.421
4 N3 N N3 N N N 0 6.853 -0.627 -0.615
5 C12 C C12 N Y N 0 4.262 0.1 -0.041
6 C11 C C11 N Y N 0 3.148 -0.709 0.048
7 C13 C C13 N Y N 0 4.176 1.333 -0.662
8 C14 C C14 N N N 0 5.395 2.215 -0.751
9 C15 C C15 N Y N 0 2.977 1.76 -1.202
10 C16 C C16 N Y N 0 1.857 0.957 -1.123
11 C10 C C10 N Y N 0 1.936 -0.284 -0.494
12 C7 C C7 N Y N 0 0.737 -1.151 -0.407
13 N2 N N2 N Y N 0 0.722 -2.461 -0.466
14 N1 N N1 N Y N 0 -0.59 -2.93 -0.348
15 C8 C C8 N Y N 0 -0.648 -0.7 -0.231
16 C9 C C9 N Y N 0 -1.245 0.558 -0.105
17 C3 C C3 N Y N 0 -2.599 0.658 0.05
18 O1 O O1 N N N 0 -3.177 1.883 0.172
19 C2 C C2 N N N 0 -2.309 3.017 0.129
20 C1 C C1 N N N 0 -3.134 4.297 0.281
21 C6 C C6 N Y N 0 -1.441 -1.862 -0.207
22 C5 C C5 N Y N 0 -2.819 -1.75 -0.05
23 C4 C C4 N Y N 0 -3.396 -0.497 0.085
24 C17 C C17 N Y N 0 -4.866 -0.375 0.254
25 C20 C C20 N Y N 0 -5.53 0.381 1.24
26 N5 N N5 N Y N 0 -6.817 0.238 1.062
27 N4 N N4 N Y N 0 -7.024 -0.607 -0.035
28 C19 C C19 N N N 0 -8.325 -1.022 -0.566
29 C18 C C18 N Y N 0 -5.819 -0.969 -0.521
30 H1 H H1 N N N 0 6.921 -1.483 -1.067
31 H2 H H2 N N N 0 7.406 0.117 -0.902
32 H3 H H3 N N N 0 3.215 -1.67 0.536
33 H4 H H4 N N N 0 5.938 1.993 -1.669
34 H5 H H5 N N N 0 5.088 3.261 -0.754
35 H6 H H6 N N N 0 6.042 2.029 0.107
36 H7 H H7 N N N 0 2.916 2.724 -1.686
37 H8 H H8 N N N 0 0.921 1.292 -1.545
38 H10 H H10 N N N 0 -0.637 1.451 -0.131
39 H11 H H11 N N N 0 -1.586 2.953 0.942
40 H12 H H12 N N N 0 -1.783 3.035 -0.826
41 H13 H H13 N N N 0 -3.858 4.361 -0.532
42 H14 H H14 N N N 0 -3.661 4.278 1.235
43 H15 H H15 N N N 0 -2.472 5.162 0.248
44 H16 H H16 N N N 0 -3.437 -2.636 -0.031
45 H17 H H17 N N N 0 -5.058 0.974 2.009
46 H18 H H18 N N N 0 -8.651 -0.31 -1.324
47 H19 H H19 N N N 0 -8.236 -2.012 -1.012
48 H20 H H20 N N N 0 -9.055 -1.051 0.242
49 H21 H H21 N N N 0 -5.641 -1.617 -1.366
50 H9 H H9 N N N 0 -0.857 -3.863 -0.364