Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02540530
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
AFB![]() | 1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE | A,B,E | 1R8Q | 0.72 | ![]() |
AFB![]() | 1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE | A | 1RE0 | 0.72 | ![]() |
AFB![]() | 1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE | A,E | 1S9D | 0.72 | ![]() |
0MA![]() | maslinic acid | A | 2QN2 | 0.7 | ![]() |
CBW![]() | (3BETA,5BETA,14BETA)-3-HYDROXY- 11-OXOOLEAN-12-EN-29-OIC ACID | A | 2W4Q | 0.71 | ![]() |
ASY![]() | (12E)-10-oxooctadec-12-enoic acid | A,B | 3CEE | 0.74 | ![]() |
13S![]() | 13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACID | A | 1IK3 | 0.73 | ![]() |
11O![]() | (TRANS-12,13-EPOXY)-11-HYDROXY- 9(Z)-OCTADECENOIC ACID | A | 1IK3 | 0.7 | ![]() |
243![]() | (9Z,11E,13S)-13-hydroxyoctadeca- 9,11-dienoic acid | A,B | 3DSJ | 0.73 | ![]() |
243![]() | (9Z,11E,13S)-13-hydroxyoctadeca- 9,11-dienoic acid | A,B | 2RCH | 0.73 | ![]() |
243![]() | (9Z,11E,13S)-13-hydroxyoctadeca- 9,11-dienoic acid | A,B | 2VST | 0.73 | ![]() |
9OH![]() | (TRANS-12,13-EPOXY)-9-HYDROXY-10(E)- OCTADECENOIC ACID | A | 1IK3 | 0.7 | ![]() |
6OC![]() | (8R,9Z,12Z)-8-hydroxy-6-oxooctadeca- 9,12-dienoic acid | A,B | 2VV4 | 0.75 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A,B | 1E3R | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 3DHE | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1J99 | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1COY | 0.71 | ![]() |
AND![]() | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1Q22 | 0.71 | ![]() |
5OP![]() | (5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA- 5,13-DIEN-1-OIC ACID | A | 2ZB4 | 0.82 | ![]() |
5OP![]() | (5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA- 5,13-DIEN-1-OIC ACID | A,B | 1V3V | 0.82 | ![]() |
C0R![]() | CORTICOSTERONE | A | 2A3I | 0.71 | ![]() |
C0R![]() | CORTICOSTERONE | A,B | 1Y5R | 0.71 | ![]() |
9HO![]() | (9S,10E,12Z)-9-hydroxyoctadeca- 10,12-dienoic acid | A,B | 2VSR | 0.73 | ![]() |
1NB![]() | 2-(2-HYDROXY-CYCLOPENTYL)-PENT- 4-ENAL | P | 1BRU | 0.75 | ![]() |
0AS![]() | asiatic acid | A | 2QN1 | 0.72 | ![]() |
13R![]() | 13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACID | A | 1IK3 | 0.73 | ![]() |
803![]() | LOVASTATIN | A,B | 1CQP | 0.76 | ![]() |
8PG![]() | (8S,12S)-15S-HYDROXY-9-OXOPROSTA- 10Z,13E-DIEN-1-OIC ACID | A,B | 2G5W | 0.84 | ![]() |
114![]() | COMPACTIN | A,B,C,D | 1HW8 | 0.76 | ![]() |
6OB![]() | (8E,10S,12Z)-10-hydroxy-6-oxooctadeca- 8,12-dienoic acid | A,B | 2VV4 | 0.76 | ![]() |