Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02269598
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 |
NBV | (2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE- 3,4,5-TRIOL | A,B | 2V3D | 0.81 | |
PTO | PSEUDOTROPINE | A,B | 2AE2 | 0.81 | |
NND | (2R,3R,4R,5S)-2-(HYDROXYMETHYL)- 1-NONYLPIPERIDINE-3,4,5-TRIOL | A,B | 2V3E | 0.81 | |
SWA | 1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B- TRIOL | A | 1HWW | 0.7 | |
SWA | 1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B- TRIOL | A | 3BLB | 0.7 | |
CCD | (4R)-4-HYDROXY-N,N,N-TRIMETHYLPENTAN- 1-AMINIUM | A,B | 2VJD | 0.73 | |
CCD | (4R)-4-HYDROXY-N,N,N-TRIMETHYLPENTAN- 1-AMINIUM | A,B | 2VJC | 0.73 | |
CCD | (4R)-4-HYDROXY-N,N,N-TRIMETHYLPENTAN- 1-AMINIUM | A,B | 2VJB | 0.73 | |
CCD | (4R)-4-HYDROXY-N,N,N-TRIMETHYLPENTAN- 1-AMINIUM | A,B | 2VJA | 0.73 | |
DFU | (2S,3R,4S,5R)-2-METHYLPIPERIDINE- 3,4,5-TRIOL | A,B | 2EAC | 0.72 |