Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03302179
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 |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.78 |  |
53N | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.72 | |
NPB | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.72 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.71 | |
| NBZ | NITROBENZENE | A,B | 3BGU | 0.71 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.78 | |
| 3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.78 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.78 | |
NIN | DINITROPHENYLENE | A | 1RSM | 0.71 | |
| NIN | DINITROPHENYLENE | A | 1GVY | 0.71 | |
| NIN | DINITROPHENYLENE | A | 1GW1 | 0.71 | |
SBN | 2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILE | A | 1JLQ | 0.77 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.76 | |
| PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.76 | |
D3F | 2-[(2,4-DICHLORO-5-METHYLPHENYL)SULFONYL]- 1,3-DINITRO-5-(TRIFLUOROMETHYL)BENZENE | A | 2GZ7 | 0.74 | |
259 | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.82 | |