Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02231307
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 |
AGT | S-{(S)-AMINO[(4-AMINOBUTYL)AMINO]METHYL}- L-CYSTEINE | A | 3H7K | 0.77 | |
AGT | S-{(S)-AMINO[(4-AMINOBUTYL)AMINO]METHYL}- L-CYSTEINE | A,B,C,D,E,F, G,H | 2JER | 0.77 | |
PEC | S,S-PENTYLTHIOCYSTEINE | A | 5NUC | 0.7 | |
CYR | N~5~-[{[(2R)-2-AMINO-2-CARBOXYETHYL]SULFANYL}(IMINIO)METHYL]- L-ORNITHINATE | A,B,C,D | 2AAF | 0.72 | |
CYR | N~5~-[{[(2R)-2-AMINO-2-CARBOXYETHYL]SULFANYL}(IMINIO)METHYL]- L-ORNITHINATE | A,B,C,D | 2ABR | 0.72 | |
DIR | 3-{[(E)-AMINO(HYDROXYIMINO)METHYL]AMINO}ALANINE | A,B,C | 1T4T | 0.71 | |
NCY | N-METHYLCYSTEINE | A,C,E,G | 2ADW | 0.73 | |
NCY | N-METHYLCYSTEINE | A | 1VS2 | 0.73 | |
NCY | N-METHYLCYSTEINE | A | 1PFE | 0.73 | |
NCY | N-METHYLCYSTEINE | A,B | 2DA8 | 0.73 | |
NCY | N-METHYLCYSTEINE | C,D | 193D | 0.73 | |
NCY | N-METHYLCYSTEINE | A | 1XVN | 0.73 | |
NCY | N-METHYLCYSTEINE | A,B | 185D | 0.73 | |
NCY | N-METHYLCYSTEINE | A | 1XVK | 0.73 | |
NCY | N-METHYLCYSTEINE | A,C | 1XVR | 0.73 | |
CDT | 4-METHYLSULFANYL-2-UREIDO-BUTYRIC ACID | A,B | 1UF5 | 0.71 | |
N2C | N,S-DIMETHYLCYSTEINE | A | 1XVK | 0.71 | |
N2C | N,S-DIMETHYLCYSTEINE | A,C | 1XVR | 0.71 | |
N2C | N,S-DIMETHYLCYSTEINE | A,B | 3GO3 | 0.71 | |
GEM | (2-GUANIDINOETHYLMERCAPTO)SUCCINIC ACID | A,B,C | 3D67 | 0.72 | |
GEM | (2-GUANIDINOETHYLMERCAPTO)SUCCINIC ACID | A | 1H8L | 0.72 | |
CMA | N2-(CARBOXYETHYL)-L-ARGININE | A,B | 1JGT | 0.72 | |
NNH | NOR-N-OMEGA-HYDROXY-L-ARGININE | A,B,C | 1HQH | 0.7 |