Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02345476
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 |
SP7 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}acetamide | A,B | 3CNP | 0.73 | |
SSM | (2S)-2-(acetylamino)-N-methyl-4- [(S)-methylsulfinyl]butanamide | A | 3BQF | 0.82 | |
AME | N-ACETYLMETHIONINE | A,B,C,D | 1SJA | 0.72 | |
AME | N-ACETYLMETHIONINE | A,B | 2J4Y | 0.72 | |
CY1 | ACETAMIDOMETHYLCYSTEINE | A,D | 1D5M | 0.72 | |
ML3 | 2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}- N,N,N-trimethylethanaminium | F | 3C1B | 0.7 | |
THT | TRANS-2-HEXADECENOYL-(N-ACETYL- CYSTEAMINE)-THIOESTER | A,B,C,D,E,F | 1BVR | 0.75 |