Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02498297
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 |
DFI | 2,2-DIFLUOROSTATINE | E,I | 1APW | 0.71 | |
LTA | 4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTER | E,I | 1APT | 0.76 | |
STA | STATINE | E | 1EPP | 0.76 | |
STA | STATINE | I | 1XN3 | 0.76 | |
STA | STATINE | A,B,I,J | 2FIV | 0.76 | |
STA | STATINE | A,B,C,D | 1QS8 | 0.76 | |
STA | STATINE | A,B | 2RMP | 0.76 | |
STA | STATINE | E,I | 1APU | 0.76 | |
STA | STATINE | A,I | 1GVU | 0.76 | |
STA | STATINE | I | 3ER5 | 0.76 | |
STA | STATINE | I | 2ER9 | 0.76 | |
STA | STATINE | E,I | 4ER2 | 0.76 | |
STA | STATINE | A,C,I,J,K | 2B7F | 0.76 | |
STA | STATINE | A,B,C | 5HVP | 0.76 | |
STA | STATINE | A,I | 1GVV | 0.76 | |
STA | STATINE | A,I | 1WKR | 0.76 | |
STA | STATINE | I | 5APR | 0.76 | |
STA | STATINE | I | 1PSO | 0.76 | |
STA | STATINE | I | 6APR | 0.76 | |
STA | STATINE | A | 1FQ5 | 0.76 | |
STA | STATINE | A,I | 3FNT | 0.76 | |
STA | STATINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 3FV3 | 0.76 | |
STA | STATINE | A,B,C,D,I,J | 1LYB | 0.76 | |
STA | STATINE | B | 1FIV | 0.76 | |
STA | STATINE | I | 4APR | 0.76 | |
CFS | 4-AMINO-5-CYCLOHEXYL-2,2-DIFLUORO- 3-HYDROXY-PENTANOIC ACID | A | 1FQ8 | 0.71 | |
OCB | OCTANOYLCARNITINE | A,B | 1XL8 | 0.71 | |
SLA | (3S,4R)-3-hydroxy-2-[(1S)-1-hydroxy- 2-methylpropyl]-4-methyl-5-oxo- D-proline | H,K,V,Y | 3DY4 | 0.7 | |
CHS | 4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID | I | 1E80 | 0.74 | |
CHS | 4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID | I | 1EED | 0.74 | |
CHS | 4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID | I | 2ER0 | 0.74 | |
ABW | 5-[1-(ACETYLAMINO)-3-METHYLBUTYL]- 2,5-ANHYDRO-3,4-DIDEOXY-4-(METHOXYCARBONYL)PENTONIC ACID | A | 1XOG | 0.72 | |
TMD | (6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N- DIMETHYL-THREONINE | C | 1CWK | 0.8 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A | 3EMY | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A | 2H6T | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1LS5 | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1SME | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,C | 1W6I | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1XDH | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 2QZX | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A | 1IZE | 0.7 | |
IHN | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1M43 | 0.7 | |
ECQ | (3S)-3-[(2S)-2-AMINO-3-HYDROXYBUTYL]PYRROLIDIN- 2-ONE | A,I | 2Z3D | 0.72 | |
MNL | 4,N-DIMETHYLNORLEUCINE | C | 1CWC | 0.71 | |
OIC | OCTAHYDROINDOLE-2-CARBOXYLIC ACID | B,C | 3BV9 | 0.71 | |
OIC | OCTAHYDROINDOLE-2-CARBOXYLIC ACID | A | 1BDK | 0.71 | |
SLR | (3R,4R)-3-hydroxy-2-[(1S)-1-hydroxy- 2-methylpropyl]-4-methyl-5-oxo- D-proline | K,Y | 3DY3 | 0.7 | |
IVS | 3-HYDROXY-6-METHYL-4-(3-METHYL- 2-(3-METHYL-2-(3-METHYL-BUTYRYLAMINO)- BUTYRYLAMINO)-BUTYRYLAMINO)-HEPTANOIC ACID ETHYL ESTER | A,B | 1ME6 | 0.74 | |
H5M | TRANS-3-HYDROXY-5-METHYLPROLINE | A,B | 1A7Z | 0.73 | |
HY3 | 3-HYDROXYPROLINE | A,B,G | 2G66 | 0.7 |