Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03102293
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 | 0.77 | |
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 | 0.77 | |
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 | 0.77 | |
RGC | REIDISPONGIOLIDE C | A | 2ASP | 0.75 | |
9OH | (TRANS-12,13-EPOXY)-9-HYDROXY-10(E)- OCTADECENOIC ACID | A | 1IK3 | 0.73 | |
1NB | 2-(2-HYDROXY-CYCLOPENTYL)-PENT- 4-ENAL | P | 1BRU | 0.72 | |
OPD | 9R,13R-12-OXOPHYTODIENOIC ACID | A,B | 1ICQ | 0.81 | |
RCL | RICINOLEIC ACID | A | 2CM4 | 0.74 | |
RCL | RICINOLEIC ACID | A | 2CM9 | 0.74 | |
RCL | RICINOLEIC ACID | A | 1FK7 | 0.74 | |
13T | 13-DEOXYTEDANOLIDE | 0,1,3,9,A,B, C,H,J,K,L,M, N,O,Q,R,S,T, U,Y,Z | 2OTJ | 0.71 | |
9HO | (9S,10E,12Z)-9-hydroxyoctadeca- 10,12-dienoic acid | A,B | 2VSR | 0.74 | |
T24 | (9Z,11E,13S,15Z)-13-hydroxyoctadeca- 9,11,15-trienoic acid | A,B | 3DSI | 0.74 | |
243 | (9Z,11E,13S)-13-hydroxyoctadeca- 9,11-dienoic acid | A,B | 3DSJ | 0.74 | |
243 | (9Z,11E,13S)-13-hydroxyoctadeca- 9,11-dienoic acid | A,B | 2RCH | 0.74 | |
243 | (9Z,11E,13S)-13-hydroxyoctadeca- 9,11-dienoic acid | A,B | 2VST | 0.74 | |
13S | 13(S)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACID | A | 1IK3 | 0.72 | |
GR3 | 3-ACETOXY-17-(1-FORMYL-5-METHYL- 3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14- TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE- 4-CARBOXYLIC ACID | B,D | 1AWH | 0.71 | |
MRC | MUPIROCIN | A | 1JZS | 0.7 | |
MRC | MUPIROCIN | A,T | 1FFY | 0.7 | |
MRC | MUPIROCIN | A | 1QU3 | 0.7 | |
MRC | MUPIROCIN | A,T | 1QU2 | 0.7 | |
1PL | (1S,3aS,5aR,8aS)-1,7,7-trimethyl- 1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene- 4-carboxylic acid | A | 2RDS | 0.7 | |
1PL | (1S,3aS,5aR,8aS)-1,7,7-trimethyl- 1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene- 4-carboxylic acid | A | 2RDN | 0.7 | |
CDZ | 3,5-dihydroxy-4,6,6-tris(3-methylbut- 2-en-1-yl)-2-(2-methylpropanoyl)cyclohexa- 2,4-dien-1-one | A | 2QNV | 0.71 | |
E4H | (3R,4S,5S,7R,9E,11R,12R)-12-ETHYL- 4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC- 9-ENE-2,8-DIONE | A,B | 2HFK | 0.84 | |
PG2 | PROSTAGLANDIN D2 | A,B | 1RY0 | 0.92 | |
11O | (TRANS-12,13-EPOXY)-11-HYDROXY- 9(Z)-OCTADECENOIC ACID | A | 1IK3 | 0.71 | |
8PG | (8S,12S)-15S-HYDROXY-9-OXOPROSTA- 10Z,13E-DIEN-1-OIC ACID | A,B | 2G5W | 0.92 | |
6OC | (8R,9Z,12Z)-8-hydroxy-6-oxooctadeca- 9,12-dienoic acid | A,B | 2VV4 | 0.8 | |
13R | 13(R)-HYDROPEROXY-9(Z),11(E)-OCTADECADIENOIC ACID | A | 1IK3 | 0.72 | |
6OB | (8E,10S,12Z)-10-hydroxy-6-oxooctadeca- 8,12-dienoic acid | A,B | 2VV4 | 0.79 | |
803 | LOVASTATIN | A,B | 1CQP | 0.71 | |
LVA | (3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6- DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}- 1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN- 1-YL)-3,5-DIHYDROXYHEPTANOIC ACID | A,B | 1T02 | 0.71 | |
114 | COMPACTIN | A,B,C,D | 1HW8 | 0.71 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B | 2CBT | 0.71 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B,C,D,E,F | 2CBQ | 0.71 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A | 2CBO | 0.71 | |
HO2 | (9E,11E,13S)-13-hydroxyoctadeca- 9,11-dienoic acid | A | 3DBM | 0.74 | |
PGX | 7-[6-(3-HYDROPEROXY-OCT-1-ENYL)- 2,3-DIOXA-BICYCLO[2.2.1]HEPT-5- YL]-HEPT-5-ENOIC ACID | A,B,C,D | 1DDX | 0.77 | |
E2P | PROSTAGLANDIN B2 | A | 1CZ2 | 0.75 | |
164 | 2-(3-CARBOXYPROPIONYL)-6-HYDROXY- CYCLOHEXA-2,4-DIENE CARBOXYLIC ACID | A | 1R6W | 0.83 | |
5OP | (5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA- 5,13-DIEN-1-OIC ACID | A | 2ZB4 | 0.92 | |
5OP | (5E,13E)-11-HYDROXY-9,15-DIOXOPROSTA- 5,13-DIEN-1-OIC ACID | A,B | 1V3V | 0.92 |