Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03717283
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 |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.76 | |
NPB | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.72 | |
TNB | S-(2,3,6-TRINITROPHENYL)CYSTEINE | A,B,C,D,E,F, G,H | 1AQX | 0.73 | |
259 | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.75 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.71 | |
NBZ | NITROBENZENE | A,B | 3BGU | 0.71 | |
GTB | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 2OAD | 0.71 | |
GTB | S-(P-NITROBENZYL)GLUTATHIONE | A,B,C,D,E,F | 1GTI | 0.71 | |
GTB | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 2OAC | 0.71 | |
GTB | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 1GLQ | 0.71 | |
GTB | S-(P-NITROBENZYL)GLUTATHIONE | B,D | 2QMC | 0.71 | |
GTB | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 2VO4 | 0.71 | |
GTB | S-(P-NITROBENZYL)GLUTATHIONE | A,B,C,D | 1K0C | 0.71 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.78 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.78 | |
53N | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.76 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.76 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.76 | |
PNC | PARA-NITROBENZYL GLUTARYL GLYCINIC ACID | L | 1YEF | 0.71 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.71 | |
TNS | A,B,L | 2G2R | 0.72 | ||
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.83 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.74 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.78 | |
DOF | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.73 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.74 | |
AAH | H | 1KEL | 0.72 | ||
AAH | B,H | 1FL6 | 0.72 |