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Ligand · XRA

XRA · 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine

XRA, 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine (C19 H21 N5 O4, 383.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
XRA
Formula
C19 H21 N5 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

XRA in 2 structures; the first of them:

  • 3OWX · X-ray Structural study of qui reductase II inhibition by compounds with micromolar to… · XRA A233 · binds TRP105, PHE106, GLY149, GLY150, MET154, TYR155, ASN161, GLU193 and 6 more
  • 3OWX · X-ray structural study of quinone reductase II inhibition by compounds with micromolar to… · XRA A233 · binds TRP105, PHE106, GLY149, GLY150, MET154, TYR155, ASN161, GLU193 and 6 more

Residues it binds most

GLY 4, PHE 4, ASN 4, GLU 4, ILE 4, MET 4, TRP 4, TYR 4, VAL 4, GLN 2 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • ZN · Zinc ion

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