Ligand · 52V
52V · 5-[(3S)-3-(5-methoxy-2',6'-dimethylbiphenyl-3-yl)but-1-yn-1-yl]-6-methylpyrimidine-2,4-diamine
52V, 5-[(3S)-3-(5-methoxy-2',6'-dimethylbiphenyl-3-yl)but-1-yn-1-yl]-6-methylpyrimidine-2,4-diamine (C24 H26 N4 O, 386.5 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its…
- Component
- 52V
- Formula
- C24 H26 N4 O
- Class
- ligand
- Structures
- 6
- PDB entries
- 3
Binding sites
52V in 6 structures; the first of them:
- 3F0Q · Staphylococcus aureus dihydrofolate reductase complexed with NADPH and… · 52V X158 · binds LEU5, VAL6, ALA7, LEU20, ASP27, LEU28, HIS30, VAL31 and 11 more
- 3F0V · Staphylococcus aureus F98Y mutant dihydrofolate reductase complexed with NADPH and… · 52V X158 · binds LEU5, VAL6, ALA7, LEU20, ASP27, LEU28, VAL31, LYS32 and 11 more
- 3LG4 · Staphylococcus aureus V31Y, F92I mutant dihydrofolate reductase complexed with NADPH and… · 52V A202 · binds LEU5, VAL6, ALA7, GLN19, LEU20, HIS23, ASP27, LEU28 and 6 more
- 3F0Q · Staphylococcus aureus dihydrofolate reductase complexed with NADPH and… · 52V X158 · binds LEU5, VAL6, ALA7, LEU20, ASP27, LEU28, HIS30, VAL31 and 11 more
- 3F0V · Staphylococcus aureus F98Y mutant dihydrofolate reductase complexed with NADPH and… · 52V X158 · binds LEU5, VAL6, ALA7, LEU20, ASP27, LEU28, VAL31, LYS32 and 11 more
- 3LG4 · Staphylococcus aureus V31Y, F92I mutant dihydrofolate reductase complexed with NADPH and… · 52V A202 · binds LEU5, VAL6, ALA7, GLN19, LEU20, HIS23, ASP27, LEU28 and 6 more
Residues it binds most
LEU 8, THR 8, ILE 8, VAL 8, ALA 8, ASP 8, LYS 4, HIS 6, PHE 4, SER 6 (residue and the binding sites it lines).
Found with
- NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate
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