Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : I7K

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 47


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C16 C C1 N N N 0 4.218 1.423 -0.7
2 C17 C C2 N N N 0 4.169 2.929 -0.699
3 C18 C C3 N N N 0 3.86 0.9 0.693
4 C19 C C4 N N N 0 3.944 -0.629 0.697
5 C15 C C5 N N N 0 3.216 0.881 -1.723
6 C13 C C6 N N N 0 -3.005 -0.969 -1.087
7 C11 C C7 N Y N 0 -5.107 0.096 -1.902
8 C12 C C8 N Y N 0 -4.123 -0.014 -0.926
9 C10 C C9 N Y N 0 -6.145 0.997 -1.735
10 C1 C C10 N Y N 0 0.391 -0.635 1.464
11 C2 C C11 N Y N 0 -0.783 0.059 1.784
12 C6 C C12 N N N 0 -3.142 0.673 1.265
13 C5 C C13 N Y N 0 -1.895 -0.049 0.95
14 C4 C C14 N Y N 0 -1.827 -0.855 -0.206
15 C8 C C15 N Y N 0 -5.24 1.69 0.38
16 C3 C C16 N Y N 0 -0.651 -1.537 -0.506
17 C7 C C17 N Y N 0 -4.19 0.792 0.226
18 O7 O O1 N N N 0 1.691 -2.97 -1.285
19 S S S1 N N N 0 1.932 -2.289 -0.062
20 O O O2 N N N 0 2.335 -2.951 1.13
21 N N N1 N N N 0 3.094 -1.153 -0.38
22 O6 O O3 N N N 0 3.878 3.523 0.312
23 O5 O O4 N N N 0 4.449 3.611 -1.821
24 C14 C C18 N N N 0 3.293 -0.649 -1.746
25 C C C19 N Y N 0 0.448 -1.423 0.327
26 O3 O O5 N N N 0 -3.059 -1.841 -1.933
27 C9 C C20 N Y N 0 -6.21 1.788 -0.603
28 O4 O O6 N N N 0 -3.308 1.165 2.364
29 O2 O O7 N N N 0 -0.838 0.831 2.898
30 O1 O O8 N N N 0 1.477 -0.533 2.272
31 H11 H H1 N N N 0 5.222 1.092 -0.965
32 H14 H H2 N N N 0 4.56 1.305 1.424
33 H13 H H3 N N N 0 2.847 1.209 0.949
34 H15 H H4 N N N 0 4.976 -0.939 0.531
35 H16 H H5 N N N 0 3.596 -1.012 1.657
36 H10 H H6 N N N 0 2.209 1.191 -1.444
37 H9 H H7 N N N 0 3.457 1.273 -2.711
38 H6 H H8 N N N 0 -5.061 -0.519 -2.789
39 H5 H H9 N N N 0 -6.909 1.082 -2.494
40 H3 H H10 N N N 0 -5.297 2.312 1.261
41 H2 H H11 N N N 0 -0.596 -2.155 -1.39
42 H12 H H12 N N N 0 4.404 4.575 -1.772
43 H7 H H13 N N N 0 2.515 -1.044 -2.398
44 H8 H H14 N N N 0 4.272 -0.96 -2.111
45 H4 H H15 N N N 0 -7.024 2.488 -0.485
46 H1 H H16 N N N 0 -0.571 1.749 2.754
47 H H H17 N N N 0 1.509 -1.198 2.974