Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00809596
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 |
NTD | 2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE | A,B | 1T47 | 0.7 |  |
NST | 3-{[(3-NITROANILINE]SULFONYL}THIOPHENE- 2-CARBOXYLIC ACID | B | 1XGI | 0.71 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.71 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.71 | |
C9P | 4-(dihydroxyboranyl)-2-({[4-(phenylsulfonyl)thiophen- 2-yl]sulfonyl}amino)benzoic acid | A,B | 3BM6 | 0.72 | |
53N | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.76 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.74 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.74 | |
| GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.74 | |
| GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.74 | |
| GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.74 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.73 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.77 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1F42 | 0.8 | |
| MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1RXE | 0.8 | |
| MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 2PER | 0.8 | |