Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00013017
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 |
DCI | 2-METHYL-BUTYLAMINE | E,I | 1ENT | 0.77 | |
DCI | 2-METHYL-BUTYLAMINE | A,I | 1GVW | 0.77 | |
DCI | 2-METHYL-BUTYLAMINE | E | 1EPP | 0.77 | |
DCI | 2-METHYL-BUTYLAMINE | I | 4ER1 | 0.77 | |
LEN | 3-METHYLBUTAN-1-AMINE | A | 1PE5 | 0.77 | |
LEN | 3-METHYLBUTAN-1-AMINE | A | 1PE7 | 0.77 | |
LEN | 3-METHYLBUTAN-1-AMINE | A | 1PE8 | 0.77 | |
3CN | 3-AMINOPROPANE | A,B,C,D | 3C0R | 0.71 | |
3CN | 3-AMINOPROPANE | B | 3BY4 | 0.71 | |
NPT | NEOPENTYLAMINE | I | 1IVQ | 0.79 | |
IBN | 2-METHYLPROPAN-1-AMINE | A,B | 2QDY | 0.76 | |
LYT | BUTYLAMINE | A | 1EAG | 0.72 | |
CDE | 1,2-DIMETHYL-PROPYLAMINE | C | 1B0R | 0.88 |