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Ligand · YFA

YFA · (2R)-2-{5-fluoro-6-[4-(1-methylpiperidin-4-yl)phenyl]-4-oxoquinazolin-3(4H)-yl}-2-phenyl-N-(1,3-thiazol-2-yl)acetamide

YFA, (2R)-2-{5-fluoro-6-[4-(1-methylpiperidin-4-yl)phenyl]-4-oxoquinazolin-3(4H)-yl}-2-phenyl-N-(1,3-thiazol-2-yl)acetamide (C31 H28 F N5 O2 S, 553.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
YFA
Formula
C31 H28 F N5 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

YFA in 2 structures; the first of them:

  • 7LTX · EGFR (T790M/V948R) in complex with quinazoli allosteric inhibitor · YFA A1103 · binds PHE723, VAL726, ALA743, ILE744, LYS745, LEU747, ALA755, GLU758 and 13 more
  • 7LTX · EGFR (T790M/V948R) in complex with quinazolinone allosteric inhibitor · YFA A1103 · binds PHE723, VAL726, ALA743, ILE744, LYS745, LEU747, ALA755, GLU758 and 13 more

Residues it binds most

ILE 8, ALA 8, LEU 8, GLU 8, MET 8, PHE 8, LYS 8, THR 8, ARG 8, ASP 8 (residue and the binding sites it lines).

Found with

  • ANP · Phosphoaminophosphonic acid-adenylate ester
  • MG · Magnesium ion

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