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Ligand · 1O0

1O0 · 6-[3-(pyridin-2-yl)-2-(trifluoromethyl)phenoxy]-1-(2,4,6-trifluorobenzyl)quinazolin-4(1H)-one

1O0, 6-[3-(pyridin-2-yl)-2-(trifluoromethyl)phenoxy]-1-(2,4,6-trifluorobenzyl)quinazolin-4(1H)-one (C27 H15 F6 N3 O2, 527.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
1O0
Formula
C27 H15 F6 N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

1O0 in 2 structures; the first of them:

  • 4JU2 · Crystal structure of hcv ns5b polymerase in complex with compound 12 · 1O0 A3002 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 9 more
  • 4JU2 · Crystal structure of HCV NS5B polymerase in complex with compound 12 · 1O0 A3002 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 9 more

Residues it binds most

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

Found with

  • MG · Magnesium ion
  • GOL · Glycerol

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