Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00019883
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 | |
BHO | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A | 1HSR | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A | 3GCK | 0.73 | |
BHO | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.73 | |
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 | |
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 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.7 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.71 | |
GW9 | 2-chloro-5-nitro-N-phenylbenzamide | A,D | 3E00 | 0.75 | |
ISN | ISATIN | A,B | 1OJA | 0.72 | |
ISN | ISATIN | A,B | 2BK5 | 0.72 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.7 | |
BVA | TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE | B,C | 2P8O | 0.71 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.74 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.7 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.7 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.7 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.7 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.82 | |
CRI | A,B | 1VKG | 0.71 | ||
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.73 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.73 | |
4PG | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.71 | |
APZ | 4-AMINOPHTHALHYDRAZIDE | A | 1ENU | 0.71 |