Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 7KI

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 84


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N N N 0 -0.394 -3.471 1.558
2 C11 C C2 N N N 0 -1.701 -3.042 1.484
3 C19 C C6 N N N 0 1.548 -2.721 0.03
4 C12 C C3 N N N 0 -1.729 -1.91 0.643
5 C14 C C4 N N N 0 3.568 -0.276 -1.625
6 C16 C C5 N N N 0 2.066 -1.686 -0.781
7 C21 C C7 N N N 0 -5.899 -0.351 -1.438
8 C24 C C8 N N N 0 -0.266 4.602 2.505
9 C2 C C9 N N N 0 1.712 3.102 1.803
10 C3 C C10 N N N 0 1.866 2.017 0.941
11 N4 N N1 N N N 0 1.602 -0.42 -0.708
12 C5 C C11 N Y N 0 -3.496 0.229 -1.633
13 C7 C C12 N Y N 0 -1.959 1.676 -0.843
14 C8 C C13 N Y N 0 -2.57 -0.474 -0.848
15 C9 C C14 N N N 0 -1.346 2.638 -0.049
16 C18 C C15 N N N 0 2.875 1.505 0.102
17 C20 C C16 N N N 0 -4.676 -0.365 -2.357
18 C23 C C17 N N N 0 -3.302 2.855 -3.732
19 C26 C C18 N N N 0 2.789 3.75 2.634
20 C27 C C19 N N N 0 2.947 2.987 3.951
21 C28 C C20 N N N 0 4.722 0.326 -2.384
22 C29 C C21 N N N 0 4.209 0.948 -3.684
23 C1 C C22 N N N 0 0.377 3.468 1.748
24 N1 N N2 N N N 0 0.596 1.562 0.79
25 C4 C C23 N N N 0 -0.271 2.588 0.857
26 C6 C C24 N Y N 0 -3.135 1.56 -1.624
27 N2 N N3 N Y N 0 -1.539 0.393 -0.769
28 N3 N N4 N N N 0 -0.436 -1.502 0.648
29 C13 C C25 N N N 0 0.359 -2.597 0.748
30 O1 O O1 N N N 1 -2.586 -1.467 -0.124
31 C25 C C29 N N N 0 -0.306 5.848 1.619
32 C15 C C26 N N N 0 3.154 -1.594 -1.66
33 C17 C C27 N N N 0 2.705 0.391 -0.745
34 C22 C C28 N N N 0 -3.86 2.684 -2.318
35 C30 C C30 N N N 0 3.751 -2.709 -2.48
36 C31 C C31 N N N 0 4.766 -3.478 -1.631
37 C32 C C32 N N N 0 0.129 -4.639 2.353
38 C33 C C33 N N N 0 0.203 -5.876 1.454
39 C34 C C34 N N N 0 -2.885 -3.667 2.175
40 C35 C C35 N N N 0 -3.146 -2.941 3.496
41 CO1 CO CO1 N N N 0 0.048 0.077 -0.02
42 H1 H H1 N N N 0 2.097 -3.649 0.097
43 H2 H H2 N N N 0 -5.688 -0.938 -0.544
44 H3 H H3 N N N 0 -6.127 0.676 -1.152
45 H4 H H4 N N N 0 -6.753 -0.781 -1.962
46 H5 H H5 N N N 0 -1.281 4.322 2.784
47 H6 H H6 N N N 0 0.313 4.813 3.404
48 H9 H H9 N N N 0 -4.448 -1.392 -2.643
49 H7 H H7 N N N 0 -1.782 3.622 -0.147
50 H8 H H8 N N N 0 3.838 1.996 0.108
51 H10 H H10 N N N 0 -4.887 0.222 -3.251
52 H11 H H11 N N N 0 -2.239 3.087 -3.677
53 H12 H H12 N N N 0 -3.444 1.931 -4.293
54 H13 H H13 N N N 0 -3.826 3.668 -4.234
55 H14 H H14 N N N 0 3.732 3.729 2.087
56 H15 H H15 N N N 0 2.514 4.784 2.844
57 H16 H H16 N N N 0 3.726 3.456 4.551
58 H17 H H17 N N N 0 2.004 3.008 4.497
59 H18 H H18 N N N 0 3.222 1.954 3.741
60 H19 H H19 N N N 0 5.196 1.096 -1.775
61 H23 H H23 N N N 0 3.736 0.178 -4.293
62 H20 H H20 N N N 0 5.45 -0.451 -2.616
63 H21 H H21 N N N 0 3.481 1.726 -3.452
64 H22 H H22 N N N 0 5.044 1.384 -4.233
65 H24 H H24 N N N 0 -3.718 3.608 -1.757
66 H25 H H25 N N N 0 -4.924 2.452 -2.372
67 H26 H H26 N N N 0 0.71 6.128 1.339
68 H27 H H27 N N N 0 -0.885 5.637 0.72
69 H28 H H28 N N N 0 -0.771 6.668 2.166
70 H29 H H29 N N N 0 2.961 -3.386 -2.803
71 H30 H H30 N N N 0 4.251 -2.29 -3.353
72 H31 H H31 N N N 0 4.266 -3.897 -0.758
73 H32 H H32 N N N 0 5.198 -4.284 -2.224
74 H33 H H33 N N N 0 5.556 -2.801 -1.308
75 H34 H H34 N N N 0 1.124 -4.405 2.731
76 H35 H H35 N N N 0 -0.54 -4.838 3.19
77 H36 H H36 N N N 0 0.581 -6.721 2.03
78 H37 H H37 N N N 0 -0.793 -6.109 1.076
79 H38 H H38 N N N 0 0.872 -5.677 0.618
80 H39 H H39 N N N 0 -3.764 -3.586 1.536
81 H40 H H40 N N N 0 -2.676 -4.719 2.373
82 H41 H H41 N N N 0 -2.267 -3.023 4.136
83 H42 H H42 N N N 0 -3.355 -1.89 3.298
84 H43 H H43 N N N 0 -4.002 -3.394 3.997