Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009580
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 |
RB3 | (1R)-3-{[(1R)-3-METHOXY-1-METHYL- 3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)- 3-HYDROXYBUTANOATE | A | 2D81 | 0.73 | |
TSD | 3-TRIMETHYLSILYL-PROPIONATE-2,2,3,3,- D4 | A | 1TUJ | 0.7 | |
CA1 | ETHYL PROPIONATE | B | 2B0F | 0.85 | |
4PA | PROPYL ACETATE | A | 1TQH | 0.81 | |
4PA | PROPYL ACETATE | A | 2O7R | 0.81 | |
GBL | GAMMA-BUTYROLACTONE | A,B | 2VWD | 0.77 | |
GBL | GAMMA-BUTYROLACTONE | A,B | 3F66 | 0.77 | |
GBL | GAMMA-BUTYROLACTONE | A | 2WD1 | 0.77 | |
GBL | GAMMA-BUTYROLACTONE | A,B | 2CBI | 0.77 | |
EEE | ETHYL ACETATE | A | 2QFL | 0.78 | |
EEE | ETHYL ACETATE | A,B,C | 1QFI | 0.78 | |
EEE | ETHYL ACETATE | A,B,C | 1YAH | 0.78 | |
EEE | ETHYL ACETATE | A,B,C | 1A7Y | 0.78 | |
BUA | BUTANOIC ACID | A | 2CZ0 | 0.7 | |
BUA | BUTANOIC ACID | A | 1P0I | 0.7 | |
BUA | BUTANOIC ACID | A,B | 2HA7 | 0.7 | |
BUA | BUTANOIC ACID | A | 1UK7 | 0.7 | |
BUA | BUTANOIC ACID | A | 2J4C | 0.7 | |
BUA | BUTANOIC ACID | A | 1ZRM | 0.7 | |
BUA | BUTANOIC ACID | A | 3DLT | 0.7 | |
BUA | BUTANOIC ACID | A | 1UGP | 0.7 | |
BUA | BUTANOIC ACID | A,B | 2CZ1 | 0.7 |