Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : QLM

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 74


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C13 C C1 N N N 0 5.084 0.213 -0.324
2 C18 C C2 N N N 0 -0.259 -1.026 -2.875
3 C17 C C3 S N N 0 0.62 0.071 -2.273
4 C15 C C4 N N N 0 2.852 0.141 -1.298
5 C19 C C5 N N N 0 -0.818 -1.945 -1.788
6 C20 C C6 N N N 0 -2.282 -2.271 -2.102
7 C22 C C7 N Y N 0 -0.208 0.958 -1.378
8 C24 C C8 N Y N 0 -0.822 2.494 0.013
9 C34 C C9 N N N 0 -7.911 0.763 1.878
10 C27 C C10 N Y N 0 -3.213 1.695 0.498
11 CL1 CL CL1 N N N 0 6.757 -3.716 2.617
12 C2 C C11 N Y N 0 8.422 -0.32 1.324
13 C3 C C12 N Y N 0 8.217 -1.538 1.946
14 C4 C C13 N Y N 0 6.998 -2.188 1.831
15 C5 C C14 N Y N 0 5.975 -1.625 1.096
16 C6 C C15 N Y N 0 6.169 -0.394 0.462
17 C7 C C16 N Y N 0 7.405 0.263 0.585
18 N8 N N1 N Y N 0 7.611 1.495 -0.043
19 C9 C C17 N Y N 0 8.645 1.848 -0.839
20 N10 N N2 N Y N 0 8.44 3.083 -1.217
21 N11 N N3 N Y N 0 7.349 3.535 -0.714
22 N12 N N4 N Y N 0 6.784 2.631 0.012
23 C14 C C18 N N N 0 3.934 -0.465 -0.521
24 O16 O O1 N N N 0 2.99 1.256 -1.767
25 N21 N N5 N N N 0 1.703 -0.536 -1.494
26 N23 N N6 N Y N 0 0.197 2.005 -0.714
27 C25 C C19 N Y N 0 -1.893 1.689 -0.169
28 N26 N N7 N Y N 0 -1.535 0.792 -1.156
29 C28 C C20 N Y N 0 -3.743 2.839 1.073
30 C29 C C21 N Y N 0 -4.976 2.791 1.694
31 C30 C C22 N Y N 0 -5.688 1.598 1.74
32 C31 C C23 N Y N 0 -5.161 0.445 1.168
33 C32 C C24 N Y N 0 -3.925 0.481 0.557
34 N33 N N8 N N N 0 -6.937 1.556 2.368
35 O35 O O2 N N N 0 -7.68 0.026 0.94
36 O36 O O3 N N N 0 -9.14 0.789 2.427
37 C37 C C25 N N N 0 -10.14 -0.091 1.849
38 C38 C C26 N N N 0 -2.975 -2.872 -0.882
39 C39 C C27 R N N 0 -4.005 -1.891 -0.302
40 N40 N N9 N N N 0 -3.307 -0.654 0.038
41 C41 C C28 N N N 0 -5.101 -1.637 -1.304
42 O42 O O4 N N N 0 -5.085 -0.632 -1.974
43 O43 O O5 N N N 0 -6.094 -2.527 -1.452
44 C44 C C29 N N N 0 -7.116 -2.217 -2.437
45 H49 H H1 N N N 0 5.207 1.202 -0.74
46 H52 H H2 N N N 0 -1.084 -0.568 -3.421
47 H53 H H3 N N N 0 0.338 -1.62 -3.571
48 H51 H H4 N N N 0 1.051 0.672 -3.077
49 H55 H H5 N N N 0 -0.243 -2.871 -1.766
50 H54 H H6 N N N 0 -0.756 -1.456 -0.819
51 H57 H H7 N N N 0 -2.783 -1.364 -2.428
52 H56 H H8 N N N 0 -2.309 -2.998 -2.921
53 H59 H H9 N N N 0 -0.779 3.356 0.662
54 H45 H H10 N N N 0 9.374 0.179 1.419
55 H46 H H11 N N N 0 9.012 -1.985 2.524
56 H47 H H12 N N N 0 5.027 -2.135 1.009
57 H48 H H13 N N N 0 9.484 1.225 -1.112
58 H50 H H14 N N N 0 3.812 -1.454 -0.105
59 H58 H H15 N N N 0 1.594 -1.424 -1.121
60 H74 H H17 N N N 0 -2.125 0.184 -1.626
61 H60 H H18 N N N 0 -3.193 3.769 1.033
62 H61 H H19 N N N 0 -5.387 3.681 2.148
63 H62 H H20 N N N 0 -5.72 -0.479 1.211
64 H63 H H21 N N N 0 -7.103 2.097 3.156
65 H64 H H22 N N N 0 -11.082 0.028 2.383
66 H66 H H23 N N N 0 -10.283 0.163 0.798
67 H65 H H24 N N N 0 -9.804 -1.125 1.93
68 H68 H H25 N N N 0 -3.483 -3.795 -1.171
69 H67 H H26 N N N 0 -2.231 -3.104 -0.117
70 H69 H H27 N N N 0 -4.441 -2.323 0.605
71 H70 H H28 N N N 0 -2.337 -0.649 -0.057
72 H71 H H29 N N N 0 -7.601 -1.278 -2.172
73 H72 H H30 N N N 0 -6.656 -2.125 -3.42
74 H73 H H31 N N N 0 -7.857 -3.017 -2.455