Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02269787
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 |
PRQ | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.74 | |
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.76 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.76 | |
KYN | KYNURENINE | A | 1XT7 | 0.76 | |
KYN | KYNURENINE | A | 1T5M | 0.76 | |
KYN | KYNURENINE | A | 1T5N | 0.76 | |
KYN | KYNURENINE | A | 2VOV | 0.76 | |
KYN | KYNURENINE | A | 2VOX | 0.76 | |
NID | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.86 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.73 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.73 | |
CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1XI2 | 0.72 | |
CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1ZX1 | 0.72 | |
CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1IDT | 0.72 | |
CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 2BZS | 0.72 | |
ISN | ISATIN | A,B | 1OJA | 0.73 | |
ISN | ISATIN | A,B | 2BK5 | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.7 | |
BHO | BENZHYDROXAMIC ACID | A | 1HSR | 0.7 | |
BHO | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.7 | |
BHO | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.7 | |
BHO | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.7 | |
BHO | BENZHYDROXAMIC ACID | A | 3GCK | 0.7 | |
BHO | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.7 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.74 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.74 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.76 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1F42 | 0.73 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1RXE | 0.73 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 2PER | 0.73 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.75 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.73 | |
TSN | TRICHOSTATIN A | A,B | 1T64 | 0.73 | |
TSN | TRICHOSTATIN A | A,B | 1C3R | 0.73 | |
TSN | TRICHOSTATIN A | A,B,C | 3F0R | 0.73 | |
TSN | TRICHOSTATIN A | A,B,C | 3C10 | 0.73 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.75 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.75 | |
SN2 | 5-[BIS-2(CHLORO-ETHYL)-AMINO]-2,4- DINTRO-BENZAMIDE | A,B | 1OO6 | 0.7 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.73 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.73 |