Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 2H0

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 63


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C4 C C4 N N N 0 -5.372 -1.324 0.278
2 C5 C C5 N Y N 0 -6.723 -1.069 -0.339
3 C6 C C6 N Y N 0 -7.832 -0.904 0.47
4 C7 C C7 N Y N 0 -9.071 -0.669 -0.095
5 C8 C C8 N Y N 0 -9.202 -0.599 -1.47
6 C9 C C9 N Y N 0 -8.093 -0.762 -2.279
7 C10 C C10 N Y N 0 -6.853 -0.993 -1.713
8 C3 C C3 N N N 0 -3.48 -0.111 1.081
9 O21 O O21 N N N 0 -2.98 -1.186 1.347
10 O4 O O4 N N N 0 -4.707 -0.058 0.528
11 N2 N N2 N N N 0 -2.808 1.028 1.339
12 C22 C C22 N N N 0 -1.473 0.971 1.941
13 N N N N N N 0 1.322 0.971 1.318
14 P P P N N N 0 -0.211 1.037 0.627
15 O2 O O2 N N N 0 -0.356 2.298 -0.133
16 O3 O O3 N N N 0 -0.406 -0.214 -0.367
17 C2 C C2 S N N 0 2.363 0.906 0.284
18 C21 C C21 N N N 0 3.5 0.043 0.768
19 O1 O O1 N N N 0 3.575 -0.259 1.941
20 C23 C C23 N N N 0 2.882 2.316 -0.006
21 C24 C C24 N N N 0 3.864 2.267 -1.178
22 C25 C C25 N N N 0 3.114 1.887 -2.456
23 C26 C C26 N N N 0 4.513 3.641 -1.357
24 C31 C C31 N N N 0 8.334 -3.056 -1.557
25 C29 C C29 N N N 0 7.486 -2.623 -0.358
26 C30 C C30 N N N 0 8.378 -1.928 0.672
27 C28 C C28 N N N 0 6.398 -1.656 -0.826
28 C27 C C27 N N N 0 5.475 -1.32 0.347
29 N21 N N21 N N N 0 4.432 -0.394 -0.101
30 H16 H H16 N N N 0 -5.497 -1.861 1.218
31 H17 H H17 N N N 0 -4.769 -1.923 -0.405
32 H18 H H18 N N N 0 -7.73 -0.959 1.544
33 H19 H H19 N N N 0 -9.938 -0.541 0.536
34 H20 H H20 N N N 0 -10.17 -0.416 -1.912
35 H21 H H21 N N N 0 -8.195 -0.708 -3.352
36 H22 H H22 N N N 0 -5.985 -1.117 -2.345
37 H23 H H23 N N N 0 -3.208 1.886 1.127
38 H14 H H14 N N N 0 -1.342 1.817 2.614
39 H15 H H15 N N N 0 -1.367 0.041 2.501
40 H13 H H13 N N N 0 -0.324 -1.076 0.064
41 H1 H H1 N N N 0 1.398 0.193 1.957
42 H2 H H2 N N N 0 1.945 0.478 -0.627
43 H3 H H3 N N N 0 2.044 2.966 -0.261
44 H4 H H4 N N N 0 3.389 2.706 0.877
45 H5 H H5 N N N 0 4.635 1.524 -0.975
46 H6 H H6 N N N 0 3.825 1.779 -3.276
47 H7 H H7 N N N 0 2.591 0.943 -2.303
48 H8 H H8 N N N 0 2.393 2.667 -2.701
49 H9 H H9 N N N 0 3.742 4.384 -1.561
50 H10 H H10 N N N 0 5.047 3.912 -0.447
51 H11 H H11 N N N 0 5.213 3.606 -2.192
52 H32 H H32 N N N 0 8.797 -2.179 -2.01
53 H33 H H33 N N N 0 9.109 -3.745 -1.223
54 H34 H H34 N N N 0 7.698 -3.551 -2.291
55 H28 H H28 N N N 0 7.023 -3.5 0.095
56 H29 H H29 N N N 0 8.841 -1.051 0.219
57 H30 H H30 N N N 0 7.775 -1.62 1.526
58 H31 H H31 N N N 0 9.154 -2.617 1.006
59 H26 H H26 N N N 0 6.86 -0.741 -1.198
60 H27 H H27 N N N 0 5.817 -2.12 -1.624
61 H24 H H24 N N N 0 5.013 -2.235 0.719
62 H25 H H25 N N N 0 6.055 -0.856 1.145
63 H12 H H12 N N N 0 4.413 -0.094 -1.023