Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 7KL

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 57


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C19 C C1 N N N 0 4.195 2.143 1.148
2 C16 C C2 N Y N 0 3.049 1.23 1.066
3 C17 C C3 N Y N 0 2.572 0.812 -0.184
4 C18 C C4 N Y N 0 1.507 -0.037 -0.259
5 C15 C C5 N Y N 0 2.434 0.771 2.239
6 C14 C C6 N Y N 0 1.368 -0.079 2.163
7 C08 C C7 N Y N 0 0.889 -0.491 0.913
8 C05 C C8 N N N 0 -0.259 -1.406 0.831
9 C01 C C9 N N N 0 -0.26 -2.677 0.353
10 C07 C C10 N Y N 0 0.888 -3.421 -0.191
11 C09 C C11 N Y N 0 1.967 -3.749 0.636
12 C10 C C12 N Y N 0 3.039 -4.445 0.123
13 C11 C C13 N Y N 0 3.05 -4.821 -1.214
14 O02 O O1 N N N 0 4.109 -5.508 -1.716
15 C12 C C14 N Y N 0 1.98 -4.498 -2.04
16 C13 C C15 N Y N 0 0.901 -3.808 -1.535
17 C02 C C16 S N N 0 -1.7 -3.178 0.495
18 C03 C C17 N N N 0 -2.506 -2.418 -0.604
19 O01 O O2 N N N 0 -2.121 -2.458 1.702
20 C06 C C18 S N N 0 -1.697 -1.123 1.275
21 C04 C C19 R N N 0 -2.505 -0.966 -0.058
22 S01 S S1 N N N 0 -4.195 -0.397 0.273
23 O06 O O3 N N N 0 -4.853 -0.056 -0.941
24 O07 O O4 N N N 0 -4.823 -1.232 1.237
25 O03 O O5 N N N 0 -4.015 0.934 0.988
26 C21 C C20 N Y N 0 -3.664 1.959 0.169
27 H1 H H1 N N N 0 4.565 2.461 2.112
28 H4 H H4 N N N 0 3.049 1.163 -1.087
29 H5 H H5 N N N 0 1.14 -0.358 -1.222
30 H6 H H6 N N N 0 2.803 1.089 3.203
31 H7 H H7 N N N 0 0.894 -0.433 3.066
32 H10 H H10 N N N 0 4.022 -6.469 -1.65
33 H11 H H11 N N N 0 1.994 -4.793 -3.079
34 H12 H H12 N N N 0 0.068 -3.561 -2.177
35 H13 H H13 N N N 0 -1.824 -4.261 0.506
36 H14 H H14 N N N 0 -1.998 -2.472 -1.567
37 H15 H H15 N N N 0 -3.522 -2.806 -0.68
38 C1 C C21 N N N 0 4.792 2.582 0.017
39 H16 H H16 N N N 0 -1.818 -0.326 2.009
40 H17 H H17 N N N 0 -1.995 -0.29 -0.744
41 C2 C C22 N N N 0 5.899 3.464 0.096
42 O1 O O6 N N N 0 6.313 3.826 1.181
43 O2 O O7 N N N 0 6.495 3.901 -1.033
44 H2 H H2 N N N 0 4.425 2.26 -0.947
45 H22 H H22 N N N 0 7.24 4.498 -0.879
46 C3 C C23 N Y N 0 -4.644 2.732 -0.437
47 C4 C C24 N Y N 0 -4.286 3.774 -1.269
48 C5 C C25 N Y N 0 -2.95 4.047 -1.501
49 C6 C C26 N Y N 0 -1.97 3.278 -0.899
50 C7 C C27 N Y N 0 -2.325 2.238 -0.06
51 CL1 CL CL1 N N N 0 -0.294 3.624 -1.192
52 H8 H H8 N N N 0 1.96 -3.456 1.676
53 H9 H H9 N N N 0 3.873 -4.699 0.761
54 H3 H H3 N N N 0 -5.688 2.519 -0.257
55 H18 H H18 N N N 0 -5.049 4.376 -1.74
56 H19 H H19 N N N 0 -2.671 4.862 -2.153
57 H20 H H20 N N N 0 -1.56 1.638 0.411