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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 1 families. | |||||
1 | 1P6D | Ki = 1.15 mM | 3PC | C21 H42 N O7 P | CCCCCC(=O).... |
2 | 1P6E | Ki = 1.21 mM | PC5 | C18 H36 N O6 P S2 | CCCCC(=O)O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1P6D | Ki = 1.15 mM | 3PC | C21 H42 N O7 P | CCCCCC(=O).... |
2 | 1P6E | Ki = 1.21 mM | PC5 | C18 H36 N O6 P S2 | CCCCC(=O)O.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PC5 | 1 | 1 |
2 | HXG | 0.591549 | 0.824561 |
3 | XP5 | 0.575342 | 0.824561 |
4 | HGP | 0.56 | 0.824561 |
5 | PC7 | 0.56 | 0.824561 |
6 | HGX | 0.56 | 0.824561 |
7 | LIO | 0.56 | 0.824561 |
8 | 6PL | 0.56 | 0.824561 |
9 | PLD | 0.56 | 0.824561 |
10 | PX4 | 0.56 | 0.824561 |
11 | PC1 | 0.532468 | 0.886792 |
12 | PCF | 0.532468 | 0.886792 |
13 | MC3 | 0.532468 | 0.886792 |
14 | PCW | 0.5 | 0.810345 |
15 | PCK | 0.488372 | 0.783333 |
16 | LBN | 0.476744 | 0.87037 |
17 | L9R | 0.476744 | 0.87037 |
18 | POV | 0.476744 | 0.87037 |
19 | PSC | 0.461538 | 0.810345 |
20 | 44E | 0.457143 | 0.603448 |
21 | DLP | 0.450549 | 0.87037 |
22 | 3PC | 0.45 | 0.867925 |
23 | PSF | 0.448718 | 0.629032 |
24 | AGA | 0.444444 | 0.610169 |
25 | PD7 | 0.444444 | 0.603448 |
26 | PEH | 0.443038 | 0.645161 |
27 | PTY | 0.443038 | 0.645161 |
28 | PEV | 0.443038 | 0.645161 |
29 | PEF | 0.443038 | 0.645161 |
30 | 8PE | 0.443038 | 0.645161 |
31 | 3PE | 0.443038 | 0.645161 |
32 | 43Y | 0.438356 | 0.789474 |
33 | 9PE | 0.4375 | 0.645161 |
34 | LPP | 0.432432 | 0.603448 |
35 | 6PH | 0.432432 | 0.603448 |
36 | 7PH | 0.432432 | 0.603448 |
37 | PA8 | 0.432432 | 0.642857 |
38 | 3PH | 0.432432 | 0.603448 |
39 | F57 | 0.432432 | 0.603448 |
40 | 8SP | 0.432099 | 0.629032 |
41 | P5S | 0.426829 | 0.629032 |
42 | PX2 | 0.426667 | 0.642857 |
43 | 7P9 | 0.426667 | 0.603448 |
44 | PX8 | 0.426667 | 0.642857 |
45 | PEE | 0.419753 | 0.66129 |
46 | CD4 | 0.4125 | 0.603448 |
47 | CDL | 0.407407 | 0.654545 |
48 | PG8 | 0.402439 | 0.610169 |
No: | Ligand | Similarity coefficient |
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This union binding pocket(no: 1) in the query (biounit: 1p6d.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |