Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : IXK

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 56


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C13 C C1 N Y N 0 -3.034 1.647 0.174
2 C15 C C2 N Y N 0 -3.706 -0.466 0.289
3 C24 C C3 N Y N 0 3.303 -1.579 -0.261
4 C26 C C4 N Y N 0 5.293 -1.084 0.529
5 C28 C C5 N Y N 0 3.733 -2.663 0.415
6 C1 C C6 N Y N 0 -9.58 -0.077 0.248
7 C3 C C7 N Y N 0 -8.71 1.61 1.562
8 C5 C C8 N Y N 0 -7.213 0.373 0.332
9 C6 C C9 N Y N 0 -8.278 -0.389 -0.177
10 C9 C C10 N Y N 0 -6.452 -1.163 -1.058
11 C11 C C11 N Y N 0 -4.768 0.311 -0.027
12 C14 C C12 N Y N 0 -2.59 0.397 0.412
13 C16 C C13 N N N 0 -2.196 2.899 0.195
14 C23 C C14 N N N 0 1.982 -1.453 -0.976
15 C27 C C15 N Y N 0 5.015 -2.347 0.925
16 C31 C C16 N Y N 0 7.035 -0.225 2.047
17 C33 C C17 N Y N 0 8.306 0.85 0.655
18 C34 C C18 N Y N 0 7.251 0.294 -0.088
19 C35 C C19 N Y N 0 9.276 1.601 -0.029
20 C37 C C20 N Y N 0 8.141 1.208 -2.0
21 N2 N N1 N Y N 0 -9.743 0.921 1.11
22 N4 N N2 N Y N 0 -7.473 1.354 1.191
23 N7 N N3 N N N 0 -10.669 -0.79 -0.223
24 N8 N N4 N Y N 0 -6.073 -0.137 -0.241
25 N10 N N5 N Y N 0 -7.745 -1.308 -1.018
26 N30 N N6 N Y N 0 6.463 -0.377 0.816
27 N32 N N7 N Y N 0 8.113 0.498 1.949
28 N36 N N8 N Y N 0 9.15 1.75 -1.344
29 N38 N N9 N Y N 0 7.209 0.497 -1.401
30 N39 N N10 N N N 0 10.338 2.174 0.649
31 O12 O O1 N Y N 0 -4.354 1.588 -0.091
32 O17 O O2 N N N 0 -1.666 3.139 -1.11
33 O18 O O3 N N N 0 -1.313 0.033 0.713
34 O20 O O4 N N N 0 -0.563 0.214 -1.69
35 O21 O O5 N N N 0 -1.236 -2.072 -0.86
36 O22 O O6 N N N 0 1.001 -0.935 -0.076
37 O25 O O7 N Y N 0 4.251 -0.624 -0.184
38 O29 O O8 N N N 0 3.062 -3.837 0.577
39 H1 H H1 N N N 0 -3.708 -1.538 0.416
40 P19 P P1 N N N 0 -0.529 -0.671 -0.504
41 H2 H H2 N N N 0 -8.887 2.414 2.261
42 H3 H H3 N N N 0 -5.779 -1.765 -1.65
43 H4 H H4 N N N 0 -2.813 3.745 0.498
44 H5 H H5 N N N 0 -1.376 2.775 0.903
45 H6 H H6 N N N 0 2.092 -0.776 -1.824
46 H7 H H7 N N N 0 1.667 -2.433 -1.332
47 H8 H H8 N N N 0 5.651 -2.993 1.513
48 H9 H H9 N N N 0 6.647 -0.639 2.966
49 H10 H H10 N N N 0 8.076 1.354 -3.068
50 H11 H H11 N N N 0 -11.564 -0.562 0.075
51 H12 H H12 N N N 0 -10.538 -1.516 -0.852
52 H13 H H13 N N N 0 10.419 2.058 1.609
53 H14 H H14 N N N 0 11.001 2.69 0.165
54 H15 H H15 N N N 0 -1.114 3.931 -1.171
55 H16 H H16 N N N 0 -1.25 -2.703 -0.127
56 H17 H H17 N N N 0 3.238 -4.49 -0.115