Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : H7B

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 67


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C4 C C1 S N N 0 0.097 -0.88 -2.12
2 C14 C C2 N N N 0 -1.608 0.025 -0.678
3 C5 C C3 N N N 0 1.221 -0.721 -1.094
4 C6 C C4 N N N 0 1.853 0.639 -1.249
5 C11 C C5 N N N 0 7.562 0.36 1.368
6 C7 C C6 N N N 0 3.498 2.326 -0.585
7 C8 C C7 N N N 0 5.009 2.141 -0.755
8 C9 C C8 N N N 0 5.551 1.308 0.409
9 C12 C C10 N N N 0 4.891 -0.073 0.4
10 C10 C C9 N N N 0 7.665 2.466 0.177
11 C13 C C11 N N N 0 3.379 0.087 0.584
12 N1 N N1 N Y N 0 -1.077 -4.232 -2.593
13 N2 N N2 N Y N 0 -0.481 -3.168 -3.007
14 C3 C C12 N Y N 0 -0.459 -2.28 -2.055
15 N3 N N3 N N N 0 2.872 1.004 -0.446
16 C1 C C13 N N N 0 -2.194 -5.08 -0.504
17 C2 C C14 N Y N 0 -1.451 -4.077 -1.349
18 N4 N N4 N N N 0 7.005 1.156 0.266
19 O1 O O1 N N N 0 1.444 1.405 -2.096
20 N5 N N5 N N N 0 -0.996 0.049 -1.81
21 C15 C C15 N Y N 0 -2.673 1.038 -0.494
22 C16 C C16 N Y N 0 -2.645 2.224 -1.227
23 C17 C C17 N Y N 0 -3.639 3.164 -1.052
24 C18 C C18 N Y N 0 -4.664 2.931 -0.151
25 CL1 CL CL1 N N N 0 -5.913 4.118 0.064
26 C19 C C19 N Y N 0 -4.698 1.755 0.58
27 C20 C C20 N Y N 0 -3.711 0.806 0.408
28 C21 C C21 N Y N 0 -1.381 -0.883 0.452
29 C22 C C22 N Y N 0 -1.157 -2.253 0.297
30 C23 C C23 N Y N 0 -0.996 -3.062 1.416
31 C24 C C24 N Y N 0 -1.026 -2.519 2.684
32 C25 C C25 N Y N 0 -1.22 -1.153 2.848
33 O2 O O2 N N N 0 -1.235 -0.616 4.097
34 C26 C C26 N N N 0 -1.045 -1.514 5.192
35 C27 C C27 N Y N 0 -1.398 -0.341 1.746
36 N6 N N6 N Y N 0 -1.042 -2.839 -0.965
37 H1 H H1 N N N 0 0.479 -0.68 -3.121
38 H3 H H3 N N N 0 0.813 -0.819 -0.089
39 H4 H H4 N N N 0 1.974 -1.492 -1.258
40 H5 H H5 N N N 0 7.106 -0.63 1.368
41 H6 H H6 N N N 0 8.64 0.263 1.238
42 H7 H H7 N N N 0 7.353 0.856 2.316
43 H8 H H8 N N N 0 3.301 2.919 0.308
44 H9 H H9 N N N 0 3.089 2.834 -1.458
45 H10 H H10 N N N 0 5.209 1.626 -1.695
46 H11 H H11 N N N 0 5.496 3.116 -0.763
47 H12 H H12 N N N 0 5.329 1.811 1.35
48 H13 H H13 N N N 0 8.741 2.324 0.073
49 H14 H H14 N N N 0 7.283 3.007 -0.688
50 H15 H H15 N N N 0 7.46 3.038 1.082
51 H16 H H16 N N N 0 5.092 -0.567 -0.55
52 H17 H H17 N N N 0 5.295 -0.674 1.215
53 H18 H H18 N N N 0 2.893 -0.884 0.48
54 H19 H H19 N N N 0 3.172 0.497 1.572
55 H20 H H20 N N N 0 -1.479 -5.716 0.018
56 H21 H H21 N N N 0 -2.812 -4.554 0.224
57 H22 H H22 N N N 0 -2.828 -5.694 -1.143
58 H26 H H26 N N N 0 -1.845 2.407 -1.929
59 H27 H H27 N N N 0 -3.618 4.083 -1.619
60 H28 H H28 N N N 0 -5.5 1.578 1.281
61 H29 H H29 N N N 0 -3.738 -0.111 0.978
62 H30 H H30 N N N 0 -0.847 -4.124 1.292
63 H31 H H31 N N N 0 -0.9 -3.155 3.547
64 H32 H H32 N N N 0 -1.079 -0.957 6.129
65 H33 H H33 N N N 0 -1.835 -2.265 5.187
66 H34 H H34 N N N 0 -0.076 -2.004 5.096
67 H35 H H35 N N N 0 -1.55 0.72 1.881