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Ligand · 1NU

1NU · 1-(2,4,6-trifluorobenzyl)-6-[2-(trifluoromethyl)phenoxy]quinazolin-4(1H)-one

1NU, 1-(2,4,6-trifluorobenzyl)-6-[2-(trifluoromethyl)phenoxy]quinazolin-4(1H)-one (C22 H12 F6 N2 O2, 450.3 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…

Component
1NU
Formula
C22 H12 F6 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

1NU in 2 structures; the first of them:

  • 4JTW · Crystal structure of HCV NS5B polymerase in complex with coupound 1 · 1NU A3002 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 5 more
  • 4JTW · Crystal structure of HCV NS5B polymerase in complex with coupound 1 · 1NU A3002 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 5 more

Residues it binds most

LEU 4, ARG 4, ALA 4, HIS 4, ILE 4, MET 4, SER 4, TRP 4, TYR 4, VAL 4 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • GOL · Glycerol

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