Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KEB

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 48


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C01 C C1 N N N 0 -4.515 2.692 -0.976
2 C02 C C2 N Y N 0 -4.214 1.231 -0.762
3 C03 C C3 N Y N 0 -2.904 0.801 -0.672
4 C04 C C4 N Y N 0 -2.627 -0.539 -0.475
5 C05 C C5 N N N 0 -1.198 -1.005 -0.378
6 C06 C C6 S N N 0 -0.745 -0.96 1.083
7 C08 C C7 N N N 0 0.384 1.149 1.628
8 C10 C C8 S N N 0 1.734 0.603 1.273
9 C11 C C9 N N N 0 2.124 1.096 -0.122
10 C12 C C10 N Y N 0 3.53 0.654 -0.437
11 C13 C C11 N Y N 0 4.599 1.462 -0.099
12 C14 C C12 N Y N 0 5.889 1.059 -0.387
13 C15 C C13 N Y N 0 6.11 -0.158 -1.016
14 C17 C C14 N Y N 0 5.035 -0.967 -1.353
15 C18 C C15 N Y N 0 3.747 -0.562 -1.058
16 C20 C C16 N N N 0 0.615 -1.579 1.195
17 C22 C C17 N Y N 0 -3.66 -1.452 -0.368
18 C23 C C18 N Y N 0 -4.971 -1.027 -0.456
19 C24 C C19 N N N 0 -6.096 -2.023 -0.339
20 C25 C C20 N Y N 0 -5.252 0.318 -0.648
21 N07 N N1 N N N 0 -0.735 0.424 1.536
22 N19 N N2 N N N 0 1.735 -0.854 1.281
23 O09 O O1 N N N 0 0.304 2.296 2.014
24 O16 O O2 N N N 0 7.378 -0.557 -1.301
25 O21 O O3 N N N 0 0.704 -2.789 1.207
26 O26 O O4 N N N 0 -6.542 0.739 -0.729
27 H1 H H1 N N N 0 -4.605 3.19 -0.011
28 H2 H H2 N N N 0 -3.707 3.15 -1.547
29 H3 H H3 N N N 0 -5.451 2.794 -1.525
30 H4 H H4 N N N 0 -2.096 1.513 -0.756
31 H5 H H5 N N N 0 -1.123 -2.027 -0.75
32 H6 H H6 N N N 0 -0.561 -0.353 -0.976
33 H7 H H7 N N N 0 -1.448 -1.53 1.691
34 H8 H H8 N N N 0 2.466 0.963 1.996
35 H9 H H9 N N N 0 1.438 0.679 -0.859
36 H10 H H10 N N N 0 2.07 2.184 -0.15
37 H11 H H11 N N N 0 4.427 2.409 0.39
38 H12 H H12 N N N 0 6.724 1.691 -0.124
39 H13 H H13 N N N 0 5.204 -1.915 -1.843
40 H14 H H14 N N N 0 2.911 -1.194 -1.317
41 H15 H H15 N N N 0 -3.441 -2.499 -0.214
42 H16 H H16 N N N 0 -6.39 -2.118 0.707
43 H17 H H17 N N N 0 -6.949 -1.679 -0.925
44 H18 H H18 N N N 0 -5.765 -2.991 -0.713
45 H19 H H19 N N N 0 -1.577 0.838 1.782
46 H20 H H20 N N N 0 2.584 -1.317 1.352
47 H21 H H21 N N N 0 7.797 -1.069 -0.596
48 H22 H H22 N N N 0 -6.9 0.736 -1.628