Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : MX8

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 52


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 CAJ C C1 N N N 0 10.026 1.672 0.362
2 CAI C C2 N N N 0 8.517 1.923 0.42
3 CAH C C3 N N N 0 7.773 0.625 0.101
4 CAG C C4 N N N 0 6.264 0.875 0.159
5 CAF C C5 N N N 0 5.519 -0.423 -0.16
6 CAE C C6 N N N 0 4.011 -0.173 -0.102
7 OAD O O1 N N N 0 3.315 -1.385 -0.4
8 CAC C C7 N Y N 0 1.959 -1.335 -0.391
9 CAL C C8 N Y N 0 1.222 -2.48 -0.672
10 CAM C C9 N Y N 0 -0.154 -2.433 -0.664
11 CAB C C10 N Y N 0 1.311 -0.142 -0.095
12 CAA C C11 N Y N 0 -0.064 -0.087 -0.084
13 CAN C C12 N Y N 0 -0.809 -1.234 -0.372
14 CAO C C13 N N N 0 -2.284 -1.18 -0.362
15 OAP O O2 N N N 0 -2.931 -2.18 -0.608
16 N N N1 N N N 0 -2.914 -0.022 -0.08
17 CA C C14 S N N 0 -4.378 0.032 -0.07
18 CB C C15 N N N 0 -4.896 -0.413 1.299
19 CG1 C C16 N N N 0 -4.555 -1.889 1.519
20 CG2 C C17 N N N 0 -4.236 0.43 2.392
21 C C C18 N N N 0 -4.831 1.442 -0.344
22 O O O3 N N N 0 -4.084 2.372 -0.125
23 NAU N N2 N N N 0 -6.067 1.671 -0.832
24 OAV O O4 N N N 0 -6.53 2.999 -0.994
25 H1 H H1 N N N 0 10.296 0.91 1.092
26 H2 H H2 N N N 0 10.299 1.332 -0.637
27 H3 H H3 N N N 0 10.556 2.597 0.589
28 H4 H H4 N N N 0 8.243 2.263 1.418
29 H5 H H5 N N N 0 8.247 2.685 -0.311
30 H6 H H6 N N N 0 8.046 0.285 -0.898
31 H7 H H7 N N N 0 8.043 -0.138 0.831
32 H8 H H8 N N N 0 5.99 1.215 1.157
33 H9 H H9 N N N 0 5.994 1.638 -0.572
34 H10 H H10 N N N 0 5.793 -0.763 -1.159
35 H11 H H11 N N N 0 5.79 -1.186 0.57
36 H12 H H12 N N N 0 3.737 0.167 0.896
37 H13 H H13 N N N 0 3.741 0.59 -0.833
38 H14 H H14 N N N 0 1.729 -3.406 -0.898
39 H15 H H15 N N N 0 -0.727 -3.322 -0.883
40 H16 H H16 N N N 0 1.888 0.744 0.128
41 H17 H H17 N N N 0 -0.567 0.84 0.147
42 H18 H H18 N N N 0 -2.399 0.775 0.116
43 H19 H H19 N N N 0 -4.772 -0.632 -0.84
44 H20 H H20 N N N 0 -5.977 -0.28 1.34
45 H21 H H21 N N N 0 -3.474 -2.022 1.478
46 H22 H H22 N N N 0 -4.924 -2.205 2.494
47 H23 H H23 N N N 0 -5.025 -2.49 0.74
48 H24 H H24 N N N 0 -4.508 1.477 2.256
49 H25 H H25 N N N 0 -4.578 0.09 3.37
50 H26 H H26 N N N 0 -3.153 0.324 2.329
51 H27 H H27 N N N 0 -6.639 0.925 -1.073
52 H28 H H28 N N N 0 -7.426 3.063 -1.35