Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : BKC

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 73


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 O3 O O1 N N N 0 4.643 -0.129 1.764
2 C3 C C1 N N N 0 -4.263 1.692 0.135
3 C2 C C2 S N N 0 -4.281 0.206 -0.227
4 C1 C C3 N N N 0 -3.275 -0.057 -1.349
5 O1 O O2 N N N 0 11.266 -1.739 -0.981
6 O2 O O3 N N N 0 10.186 -0.332 0.36
7 C4 C C4 N N N 0 -2.919 2.053 0.712
8 C5 C C5 N N N 0 -2.221 3.029 0.187
9 C6 C C6 N N N 0 -0.876 3.39 0.763
10 C7 C C7 N N N 0 0.182 3.343 -0.341
11 C8 C C8 N N N 0 1.526 3.703 0.236
12 C9 C C9 N N N 0 2.556 2.876 0.088
13 C10 C C10 N N N 0 3.869 3.229 0.651
14 C11 C C11 N N N 0 4.921 2.451 0.42
15 C12 C C12 N N N 0 4.744 1.135 -0.293
16 C13 C C13 R N N 0 5.369 0.015 0.542
17 C14 C C14 N N N 0 5.314 -1.277 -0.231
18 C15 C C15 N N N 0 6.44 -1.836 -0.678
19 C16 C C16 N N N 0 7.736 -1.281 -0.288
20 C17 C C17 N N N 0 8.874 -1.779 -0.825
21 C18 C C18 N N N 0 8.806 -2.905 -1.823
22 C19 C C19 N N N 0 10.131 -1.242 -0.447
23 C20 C C20 N N N 0 3.987 -1.939 -0.498
24 C21 C C21 N N N 0 5.258 0.511 2.884
25 C22 C C22 N N N 0 -5.662 -0.182 -0.688
26 C23 C C23 N N N 0 -6.344 -1.124 -0.033
27 C24 C C24 N N N 0 -7.685 -1.501 -0.481
28 C25 C C25 N N N 0 -8.432 -2.349 0.261
29 C26 C C26 N N N 0 -8.043 -2.662 1.588
30 O4 O O4 N N N 0 -7.106 -2.079 2.1
31 O5 O O5 N N N 0 -8.711 -3.606 2.283
32 C27 C C27 N N N 0 -8.233 -0.944 -1.77
33 C28 C C28 N N N 0 -8.856 0.404 -1.51
34 O6 O O6 N N N 0 -8.855 0.864 -0.393
35 O7 O O7 N N N 0 -9.412 1.092 -2.519
36 H1 H H1 N N N 0 -4.446 2.287 -0.76
37 H2 H H2 N N N 0 -5.041 1.896 0.872
38 H3 H H3 N N N 0 -4.011 -0.385 0.649
39 H4 H H4 N N N 0 -2.276 0.224 -1.015
40 H5 H H5 N N N 0 -3.288 -1.116 -1.607
41 H6 H H6 N N N 0 -3.545 0.533 -2.225
42 H7 H H7 N N N 0 12.071 -1.309 -0.663
43 H8 H H8 N N N 0 -2.53 1.507 1.559
44 H9 H H9 N N N 0 -2.609 3.575 -0.66
45 H10 H H10 N N N 0 -0.919 4.395 1.183
46 H11 H H11 N N N 0 -0.615 2.679 1.548
47 H12 H H12 N N N 0 0.224 2.338 -0.761
48 H13 H H13 N N N 0 -0.08 4.053 -1.125
49 H14 H H14 N N N 0 1.653 4.634 0.769
50 H15 H H15 N N N 0 2.429 1.946 -0.445
51 H16 H H16 N N N 0 3.977 4.119 1.253
52 H17 H H17 N N N 0 5.904 2.763 0.742
53 H18 H H18 N N N 0 3.681 0.937 -0.429
54 H19 H H19 N N N 0 5.233 1.18 -1.266
55 H20 H H20 N N N 0 6.407 0.263 0.762
56 H21 H H21 N N N 0 6.395 -2.697 -1.328
57 H22 H H22 N N N 0 7.785 -0.474 0.427
58 H23 H H23 N N N 0 8.728 -2.494 -2.83
59 H24 H H24 N N N 0 9.708 -3.513 -1.748
60 H25 H H25 N N N 0 7.933 -3.524 -1.615
61 H26 H H26 N N N 0 3.58 -1.571 -1.44
62 H27 H H27 N N N 0 4.125 -3.019 -0.56
63 H28 H H28 N N N 0 3.295 -1.707 0.312
64 H29 H H29 N N N 0 4.7 0.273 3.79
65 H30 H H30 N N N 0 6.284 0.157 2.986
66 H31 H H31 N N N 0 5.26 1.59 2.731
67 H32 H H32 N N N 0 -6.099 0.301 -1.549
68 H33 H H33 N N N 0 -5.907 -1.607 0.828
69 H34 H H34 N N N 0 -9.326 -2.789 -0.157
70 H35 H H35 N N N 0 -8.373 -3.75 3.177
71 H36 H H36 N N N 0 -7.424 -0.837 -2.493
72 H37 H H37 N N N 0 -8.988 -1.622 -2.167
73 H38 H H38 N N N 0 -9.799 1.952 -2.304