Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02658051
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 |
NPB | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.74 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.72 | |
NIN | DINITROPHENYLENE | A | 1RSM | 0.72 | |
NIN | DINITROPHENYLENE | A | 1GVY | 0.72 | |
NIN | DINITROPHENYLENE | A | 1GW1 | 0.72 | |
NID | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.77 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.74 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.81 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1F42 | 0.74 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1RXE | 0.74 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 2PER | 0.74 | |
53N | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.73 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.8 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.75 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.79 | |
NTD | 2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE | A,B | 1T47 | 0.74 | |
BPN | PARANITROBENZYL ALCOHOL | H,L | 1YEG | 0.73 | |
MAZ | FORMIC ACID 3-AMINO-BENZYL ESTER | H,L | 1JYQ | 0.7 | |
AAH | H | 1KEL | 0.75 | ||
AAH | B,H | 1FL6 | 0.75 | ||
NPA | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.71 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.73 | |
NBZ | NITROBENZENE | A,B | 3BGU | 0.73 | |
DOF | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.73 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.81 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.81 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.73 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.73 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.73 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.73 |