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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 277 families. | |||||
1 | 6CI4 | - | F5P | C17 H28 N4 O15 P2 | C[C@H]1[C@.... |
2 | 6CI5 | - | 1YJ | C19 H23 N7 O6 | c1cc(ccc1C.... |
3 | 6EDK | - | 1YA | C20 H23 N7 O7 | c1cc(ccc1C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 212 families. | |||||
1 | 6CI4 | - | F5P | C17 H28 N4 O15 P2 | C[C@H]1[C@.... |
2 | 6CI5 | - | 1YJ | C19 H23 N7 O6 | c1cc(ccc1C.... |
3 | 6EDK | - | 1YA | C20 H23 N7 O7 | c1cc(ccc1C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | UD4 | 1 | 1 |
2 | F5P | 1 | 1 |
3 | F5G | 0.782178 | 0.985507 |
4 | MJZ | 0.754902 | 0.971429 |
5 | HP7 | 0.745098 | 0.971014 |
6 | UD2 | 0.742574 | 0.957143 |
7 | UD1 | 0.742574 | 0.957143 |
8 | UD7 | 0.711538 | 0.985507 |
9 | UDZ | 0.688073 | 0.881579 |
10 | AWU | 0.683673 | 0.971014 |
11 | EEB | 0.654867 | 0.957747 |
12 | EPZ | 0.646018 | 0.971429 |
13 | UGB | 0.640777 | 0.956522 |
14 | UGA | 0.640777 | 0.956522 |
15 | EPU | 0.640351 | 0.930556 |
16 | UFM | 0.623762 | 0.942857 |
17 | UPG | 0.623762 | 0.942857 |
18 | GDU | 0.623762 | 0.942857 |
19 | UGF | 0.619048 | 0.90411 |
20 | 12V | 0.607143 | 0.90411 |
21 | HWU | 0.607143 | 0.90411 |
22 | UPF | 0.605769 | 0.891892 |
23 | UAD | 0.605769 | 0.942857 |
24 | UDX | 0.605769 | 0.942857 |
25 | U2F | 0.605769 | 0.891892 |
26 | G3N | 0.603774 | 0.943662 |
27 | 4RA | 0.603053 | 0.883117 |
28 | UMA | 0.598361 | 0.971429 |
29 | USQ | 0.59434 | 0.825 |
30 | UFG | 0.590476 | 0.891892 |
31 | UDM | 0.581818 | 0.916667 |
32 | UDP | 0.578947 | 0.914286 |
33 | UTP | 0.57732 | 0.914286 |
34 | UNP | 0.575758 | 0.888889 |
35 | U5F | 0.571429 | 0.914286 |
36 | U20 | 0.570312 | 0.860759 |
37 | U21 | 0.570312 | 0.860759 |
38 | U22 | 0.570312 | 0.839506 |
39 | UDH | 0.552381 | 0.844156 |
40 | IUG | 0.542373 | 0.814815 |
41 | UAG | 0.540146 | 0.918919 |
42 | UD0 | 0.536232 | 0.871795 |
43 | URM | 0.53271 | 0.902778 |
44 | 660 | 0.53271 | 0.902778 |
45 | 3UC | 0.526786 | 0.891892 |
46 | UPP | 0.523364 | 0.915493 |
47 | UPU | 0.519231 | 0.914286 |
48 | U | 0.515789 | 0.9 |
49 | U5P | 0.515789 | 0.9 |
50 | UML | 0.506757 | 0.884615 |
51 | 44P | 0.5 | 0.876712 |
52 | 2KH | 0.495146 | 0.888889 |
53 | UDP UDP | 0.485149 | 0.885714 |
54 | PMP UD1 | 0.475177 | 0.860759 |
55 | UDP GAL | 0.464912 | 0.915493 |
56 | 2QR | 0.460432 | 0.82716 |
57 | Y6W | 0.460177 | 0.866667 |
58 | UP5 | 0.448819 | 0.857143 |
59 | C5G | 0.448276 | 0.917808 |
60 | 4TC | 0.430769 | 0.835443 |
61 | 0FX | 0.42623 | 0.92 |
62 | CXY | 0.420168 | 0.917808 |
63 | FZK | 0.415929 | 0.761905 |
64 | CSV | 0.414634 | 0.855263 |
65 | CSQ | 0.414634 | 0.855263 |
66 | LSU | 0.413793 | 0.764706 |
67 | YSU | 0.413223 | 0.752941 |
68 | URI | 0.410526 | 0.814286 |
69 | 2GW | 0.408 | 0.90411 |
70 | U1S | 0.40708 | 0.779221 |
71 | UAG API | 0.401235 | 0.883117 |
No: | Ligand | Similarity coefficient |
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