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Ligand · DQ0

DQ0 · 4-[3-[[2,6-bis(azanyl)-5-(3-chlorophenyl)pyrimidin-4-yl]methoxy]phenoxy]butanoic acid

DQ0, 4-[3-[[2,6-bis(azanyl)-5-(3-chlorophenyl)pyrimidin-4-yl]methoxy]phenoxy]butanoic acid (C21 H21 Cl N4 O4, 428.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
DQ0
Formula
C21 H21 Cl N4 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

DQ0 in 2 structures; the first of them:

  • 6KOT · Quadruple mutant (N51I+C59R+S108N+I164L) plasmodium falciparum dihydrofolate… · DQ0 A701 · binds ILE14, CYS15, ALA16, LEU46, ASP54, MET55, PHE58, ARG59 and 7 more
  • 6KOT · Quadruple mutant (N51I+C59R+S108N+I164L) plasmodium falciparum dihydrofolate… · DQ0 A701 · binds ILE14, CYS15, ALA16, LEU46, ASP54, MET55, PHE58, ARG59 and 7 more

Residues it binds most

ARG 4, ILE 4, LEU 4, PHE 4, ALA 4, ASN 4, ASP 4, CYS 4, THR 4, TYR 4 (residue and the binding sites it lines).

Found with

  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate
  • UMP · 2'-deoxyuridine 5'-monophosphate

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