Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00021502
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 |
BUA![]() | BUTANOIC ACID | A | 2CZ0 | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A | 1P0I | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A,B | 2HA7 | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A | 1UK7 | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A | 2J4C | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A | 1ZRM | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A | 3DLT | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A | 1UGP | 0.71 | ![]() |
BUA![]() | BUTANOIC ACID | A,B | 2CZ1 | 0.71 | ![]() |
DHD![]() | 2,4-DIOXO-PENTANEDIOIC ACID | A,B,C,D | 1CS1 | 0.71 | ![]() |
MEV![]() | (R)-MEVALONATE | A,B | 1QAY | 0.7 | ![]() |
MEV![]() | (R)-MEVALONATE | A | 2HFU | 0.7 | ![]() |
MEV![]() | (R)-MEVALONATE | A,B | 1R31 | 0.7 | ![]() |
4AT![]() | 5-OXOHEXANOIC ACID | A,B | 2EFY | 0.73 | ![]() |
GUA![]() | GLUTARIC ACID | A,B | 1JW0 | 0.88 | ![]() |
GUA![]() | GLUTARIC ACID | A,B,C,D | 1B4N | 0.88 | ![]() |
GUA![]() | GLUTARIC ACID | A | 1AMS | 0.88 | ![]() |
GUA![]() | GLUTARIC ACID | A,B | 1XEY | 0.88 | ![]() |
GUA![]() | GLUTARIC ACID | A | 1CZC | 0.88 | ![]() |
GUA![]() | GLUTARIC ACID | A,B,C | 1IYD | 0.88 | ![]() |
3HG![]() | 3-HYDROXYPENTANEDIOIC ACID | A,B,C,D,E,F | 2CW6 | 0.76 | ![]() |
6NA![]() | HEXANOIC ACID | A,B | 2IX4 | 0.73 | ![]() |
6NA![]() | HEXANOIC ACID | A,B | 2IWZ | 0.73 | ![]() |
6NA![]() | HEXANOIC ACID | A | 2IQ0 | 0.73 | ![]() |
SHO![]() | 5-HYDROXYLAEVULINIC ACID | A | 1W31 | 0.81 | ![]() |
SHF![]() | LAEVULINIC ACID | A | 1YLV | 0.71 | ![]() |
SHF![]() | LAEVULINIC ACID | A | 1H7N | 0.71 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,B,C | 1I1M | 0.71 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,B,C | 2EIY | 0.71 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A | 2ECO | 0.71 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,C,D | 1UMC | 0.71 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,B | 2COG | 0.71 | ![]() |
HKV![]() | 4,5-DIOXOPENTANOIC ACID | A | 2JB8 | 0.71 | ![]() |
MAH![]() | 3-HYDROXY-3-METHYL-GLUTARIC ACID | A,B,C,D | 1DQA | 0.74 | ![]() |
MAH![]() | 3-HYDROXY-3-METHYL-GLUTARIC ACID | A,B,C,D | 1DQ8 | 0.74 | ![]() |
LEA![]() | LEVULINIC ACID | P | 1VWR | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | M,P | 1VWJ | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | A,B | 1W1Z | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | A,B | 1B4K | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | M,P | 1VWK | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | P | 1VWQ | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | A | 1UK8 | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | M,P | 1VWL | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | M,P | 1VWI | 0.79 | ![]() |
LEA![]() | LEVULINIC ACID | A | 1B4E | 0.79 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D | 1YBA | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1DS1 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1H2L | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C | 1NX8 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 3BUC | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2RDN | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 3BIE | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,D | 1OIK | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D | 3DC1 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FDF | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 3D8C | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1DRY | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FDH | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C | 2J9E | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 2QFY | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1UNB | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D | 1OIJ | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 2QFX | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 1GQW | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 3BKZ | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2GP5 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 3GJB | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1GP4 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2RDQ | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 1HWY | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2VDC | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 3BU0 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FCT | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,F,G | 2Q8C | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 1GY9 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D | 1OII | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2A1X | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1H2N | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C | 1NX4 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2BRT | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FCV | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FDI | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2YU1 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FDK | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1E5I | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1UOB | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 1OFE | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2ILM | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FCU | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 1AIB | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1RXG | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1MZF | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 1EA0 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1DRT | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2IUW | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D | 3BN1 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 2FD8 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2JJH | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1IKA | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B,C,D | 1OS7 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1MDX | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 1OFD | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2CJH | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1GP5 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1CW4 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A,B | 3BI3 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1BL5 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1LLW | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 2ZE3 | 0.73 | ![]() |
AKG![]() | 2-OXYGLUTARIC ACID | A | 1GVG | 0.73 | ![]() |
MSU![]() | SUCCINIC ACID MONOMETHYL ESTER | A,B,I,J | 2RDL | 0.73 | ![]() |
MSU![]() | SUCCINIC ACID MONOMETHYL ESTER | I | 1HNE | 0.73 | ![]() |
MSU![]() | SUCCINIC ACID MONOMETHYL ESTER | A,B | 2H5D | 0.73 | ![]() |
MSU![]() | SUCCINIC ACID MONOMETHYL ESTER | E,I | 3PRK | 0.73 | ![]() |
TRC![]() | TRICARBALLYLIC ACID | A | 6ACN | 0.73 | ![]() |
TRC![]() | TRICARBALLYLIC ACID | A,B | 2PW0 | 0.73 | ![]() |
TRC![]() | TRICARBALLYLIC ACID | A | 5ACN | 0.73 | ![]() |