Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KIG

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 86


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N N N 0 1.801 2.725 2.283
2 C7 C C1 N N N 0 1.112 -0.763 -0.219
3 C8 C C2 N N N 0 -0.19 -0.107 -0.423
4 N2 N N2 N Y N 0 4.605 -1.274 0.366
5 C9 C C3 N N N 0 0.11 -0.016 -2.823
6 O1 O O1 N N N 0 0.855 4.966 2.221
7 C1 C C4 N N N 0 -0.879 2.992 1.758
8 O5 O O2 N N N 0 -2.81 -0.193 -0.945
9 C5 C C5 N Y N 0 3.417 -1.925 0.142
10 C6 C C6 N N N 0 2.151 -1.286 -0.056
11 N3 N N3 N N N 0 -0.119 0.766 -1.602
12 C4 C C7 R N N 0 4.799 0.176 0.444
13 O4 O O3 N N N 0 0.761 2.07 -3.704
14 C3 C C8 R N N 0 3.7 2.175 0.842
15 O3 O O4 N N N 0 0.708 0.424 -5.178
16 C2 C C9 N N N 0 2.257 2.682 0.891
17 N4 N N4 N Y N 0 -4.745 -1.092 0.129
18 N N N5 N N N 0 -3.233 3.335 1.174
19 C C C10 N N N 0 -2.107 3.887 1.939
20 O O O5 N N N 0 0.336 3.433 4.092
21 C10 C C11 N N N 0 0.55 0.903 -3.934
22 C11 C C12 N N N 0 -1.33 1.588 -1.722
23 C12 C C13 R N N 0 -2.525 0.69 -2.051
24 C13 C C14 R N N 0 -4.18 -0.61 -1.133
25 C14 C C15 N Y N 0 -4.321 -0.76 1.382
26 C15 C C16 N Y N 0 -5.982 -2.128 1.651
27 C16 C C17 N Y N 0 -7.014 -2.978 2.084
28 C17 C C18 N Y N 0 -7.559 -3.385 -0.121
29 C18 C C19 N Y N 0 -5.801 -1.957 0.268
30 C19 C C20 R N N 0 -4.918 0.664 -1.601
31 C20 C C21 S N N 0 -3.805 1.539 -2.219
32 C21 C C22 N Y N 0 4.929 -3.473 0.358
33 C22 C C23 N Y N 0 5.705 -4.642 0.456
34 C23 C C24 N Y N 0 7.57 -3.332 0.822
35 C24 C C25 N Y N 0 5.576 -2.233 0.509
36 C25 C C26 R N N 0 4.641 0.824 -0.955
37 C26 C C27 S N N 0 4.242 2.276 -0.597
38 N10 N N6 N N N 0 5.126 -5.891 0.315
39 N11 N N7 N Y N 0 7.008 -4.52 0.686
40 N12 N N8 N Y N 0 6.885 -2.212 0.738
41 N5 N N9 N Y N 0 -5.05 -1.366 2.273
42 N6 N N10 N N N 0 -7.24 -3.185 3.434
43 N7 N N11 N Y N 0 -7.767 -3.577 1.168
44 N8 N N12 N Y N 0 -6.605 -2.598 -0.573
45 N9 N N13 N Y N 0 3.62 -3.221 0.137
46 O2 O O6 N N N 0 3.747 0.789 1.22
47 O6 O O7 N N N 0 -5.903 0.339 -2.585
48 O7 O O8 N N N 0 -4.067 1.781 -3.603
49 O8 O O9 N N N 0 5.876 0.797 -1.673
50 O9 O O10 N N N 0 5.384 3.134 -0.642
51 S S S1 N N N 0 0.511 3.674 2.703
52 H1 H H1 N N N 0 2.253 2.194 2.957
53 H2 H H2 N N N 0 -0.958 -0.865 -0.577
54 H3 H H3 N N N 0 -0.438 0.488 0.456
55 H4 H H4 N N N 0 0.885 -0.76 -2.639
56 H5 H H5 N N N 0 -0.813 -0.518 -3.112
57 H6 H H6 N N N 0 -1.106 1.988 2.119
58 H7 H H7 N N N 0 -0.614 2.947 0.702
59 H9 H H9 N N N 0 5.776 0.41 0.866
60 H10 H H10 N N N 0 4.322 2.765 1.515
61 H11 H H11 N N N 0 0.991 1.052 -5.857
62 H12 H H12 N N N 0 1.616 2.011 0.319
63 H13 H H13 N N N 0 2.209 3.683 0.462
64 H14 H H14 N N N 0 -3.421 2.381 1.445
65 H15 H H15 N N N 0 -4.056 3.909 1.277
66 H17 H H17 N N N 0 -2.372 3.932 2.995
67 H18 H H18 N N N 0 -1.881 4.891 1.579
68 H19 H H19 N N N 0 -1.513 2.106 -0.78
69 H20 H H20 N N N 0 -1.195 2.32 -2.518
70 H21 H H21 N N N 0 -2.328 0.115 -2.955
71 H22 H H22 N N N 0 -4.238 -1.386 -1.896
72 H23 H H23 N N N 0 -3.501 -0.093 1.602
73 H24 H H24 N N N 0 -8.195 -3.892 -0.832
74 H25 H H25 N N N 0 -5.378 1.172 -0.753
75 H29 H H29 N N N 0 3.466 2.637 -1.273
76 H26 H H26 N N N 0 -3.713 2.48 -1.676
77 H27 H H27 N N N 0 8.633 -3.279 1.008
78 H28 H H28 N N N 0 3.851 0.333 -1.524
79 H30 H H30 N N N 0 5.671 -6.69 0.384
80 H31 H H31 N N N 0 4.173 -5.967 0.147
81 H35 H H35 N N N 0 -4.892 2.258 -3.769
82 H32 H H32 N N N 0 -6.683 -2.741 4.093
83 H33 H H33 N N N 0 -7.956 -3.774 3.721
84 H34 H H34 N N N 0 -6.356 1.108 -2.957
85 H36 H H36 N N N 0 5.828 1.191 -2.555
86 H37 H H37 N N N 0 5.766 3.234 -1.525