Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02513299
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 |
DUX | 2,3-DEOXY-3-FLUORO-5-O-TRITYLURIDINE | A,B,C | 1VYQ | 0.71 | |
BAU | 1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE- 2,4(1H,3H)-DIONE | A,B,C,D,E,F | 1U1C | 0.74 | |
BAU | 1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE- 2,4(1H,3H)-DIONE | A,B,C,D | 3EUF | 0.74 | |
681 | 2-(5-AMINO-6-OXO-2-PHENYL-6H-PYRIMIDIN- 1-YL)-N-[2-(5-TERT-BUTYL-1,3,4- OXADIAZOL-2-YL)-1-(METHYLETHYL)- 2-HYDROXYETHYL]ACETAMIDE | A | 1FZZ | 0.72 | |
DPB | (S)-1-[2'-DEOXY-3',5'-O-(1-PHOSPHONO)BENZYLIDENE- B-D-THREO-PENTOFURANOSYL]THYMINE | A | 1Q91 | 0.7 | |
XCY | {5-[4-{[4-(AMINOMETHYL)BENZYL]AMINO}- 2-OXOPYRIMIDIN-1(2H)- YL]-3-HYDROXYTETRAHYDROFURAN- 2-YL}METHYL DIHYDROGEN PHOSPHATE | A,B,C,D,F | 1YFH | 0.75 | |
BOE | A,B | 1YBC | 0.75 | ||
NBX | N-{[(4-aminophenyl)carbonyl]carbamoyl}- beta-D-glucopyranosylamine | A | 2QN9 | 0.73 | |
BZD | A | 1K06 | 0.75 | ||
BZD | A | 1K08 | 0.75 | ||
BZD | A | 2QNB | 0.75 | ||
F68 | N-{[(4-methylphenyl)carbonyl]carbamoyl}- beta-D-glucopyranosylamine | A | 2QLM | 0.74 | |
F59 | N-[(biphenyl-4-ylcarbonyl)carbamoyl]- beta-D-glucopyranosylamine | A | 2QLN | 0.72 | |
SOS | [(1R,2S,4R)-4-({2-AMINO-5-[BENZYL(FORMYL)AMINO]- 6-OXO-1,6-DIHYDROPYRIMIDIN-4-YL}AMINO)- 2-HYDROXYCYCLOPENTYL]METHYL DIHYDROGEN PHOSPHATE | A,B | 3C58 | 0.75 |