Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01074122
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 |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.74 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.74 | |
UA5 | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.71 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.7 | |
D3F | 2-[(2,4-DICHLORO-5-METHYLPHENYL)SULFONYL]- 1,3-DINITRO-5-(TRIFLUOROMETHYL)BENZENE | A | 2GZ7 | 0.71 | |
NIN | DINITROPHENYLENE | A | 1RSM | 0.73 | |
NIN | DINITROPHENYLENE | A | 1GVY | 0.73 | |
NIN | DINITROPHENYLENE | A | 1GW1 | 0.73 | |
FLM | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.71 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.79 | |
NR2 | N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)- 4-METHYLBENZENESULFONAMIDE | A | 1ZFK | 0.7 | |
I7C | 4-AMINO-6-(TRIFLUOROMETHYL)BENZENE- 1,3-DISULFONAMIDE | A | 2POW | 0.71 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.72 | |
NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.72 | |
NIT | 4-NITROANILINE | B | 1VBS | 0.72 | |
NIT | 4-NITROANILINE | C | 1V9T | 0.72 | |
NIT | 4-NITROANILINE | C,D | 1VBT | 0.72 | |
NIT | 4-NITROANILINE | B | 1LOP | 0.72 | |
NIT | 4-NITROANILINE | C,D | 1ZKF | 0.72 | |
NIT | 4-NITROANILINE | B | 1PIP | 0.72 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.76 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.76 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.77 |