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Ligand · XX4

XX4 · 3-(2-amino-6-benzoylquinazolin-3(4H)-yl)-N-cyclohexyl-N-methylpropanamide

XX4, 3-(2-amino-6-benzoylquinazolin-3(4H)-yl)-N-cyclohexyl-N-methylpropanamide (C25 H30 N4 O2, 418.5 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
XX4
Formula
C25 H30 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

XX4 in 2 structures; the first of them:

  • 2Q11 · Structure of BACE complexed to compound 1 · XX4 A501 · binds LEU30, ASP32, GLY34, SER35, VAL69, TYR71, GLY74, LYS75 and 10 more
  • 2Q11 · Structure of bace complexed to compound 1 · XX4 A501 · binds LEU30, ASP32, GLY34, SER35, VAL69, TYR71, GLY74, LYS75 and 10 more

Residues it binds most

ASP 6, GLY 6, ILE 6, LYS 6, TRP 6, LEU 6, PHE 6, SER 6, THR 6, TYR 6 (residue and the binding sites it lines).

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