Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00012412
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 |
HFB | hexafluorobenzene | A | 3DMZ | 0.87 | |
FIB | 1,2,3,4,5-pentafluoro-6-iodobenzene | A | 3DN8 | 0.81 | |
IBF | 1,2,3,4,5-pentafluoro-6-iodobenzene | A | 3DN3 | 0.81 | |
BCF | 1-chloro-2,3,4,5,6-pentafluorobenzene | A | 3DN1 | 0.74 | |
F5B | 1,2,3,4,5-pentafluorobenzene | A | 3DN0 | 0.76 | |
BBF | 1-bromo-2,3,4,5,6-pentafluorobenzene | A | 3DN2 | 0.72 | |
BT6 | benzenethiol | A,B,C,D | 3HSR | 0.73 |