Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00007195
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 |
B71 | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEU | 0.71 |  |
| B71 | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEV | 0.71 | |
OBI | 1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME | A,B | 2GYW | 0.73 | |
PY7 | PYRIDIN-4-YLMETHANOL | A | 2EUR | 0.72 | |
PY2 | 3-(MERCAPTOMETHYLENE)PYRIDINE | A,B | 1IDA | 0.7 | |
3MP | 3-METHYLPYRIDINE | A | 1EUB | 0.74 | |
| 3MP | 3-METHYLPYRIDINE | A | 1BM6 | 0.74 | |
PYS | 2-PYRIDINETHIOL | A,B | 1CTE | 0.71 | |
| PYS | 2-PYRIDINETHIOL | A | 2IPP | 0.71 | |
SPY | 4-HYDROSULFONYLPYRIDINE | A,B | 1IDB | 0.72 | |
714 | 1-(2,2-diphosphonoethyl)-3-(octyloxy)pyridinium | A,B | 3EFQ | 0.72 | |
282 | 3-methoxypyridine | X | 2RBZ | 0.84 | |
721 | 3-butoxy-1-(2,2-diphosphonoethyl)pyridinium | A,B | 3DYH | 0.74 | |
PCH | 3-AMINO-4-CYCLOHEXYL-1-(PYRIDIN- 4-YLOXY)BUTAN-2-OL | I | 1E82 | 0.73 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.72 | |
722 | 1-(2,2-diphosphonoethyl)-3-(heptyloxy)pyridinium | A,B | 3EGT | 0.72 | |
PYF | 3-PYRIDINYLCARBINOL | A,B | 1R16 | 0.71 | |