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Ligand · BFI

BFI · 2[4-bromo-2-fluorophenyl)methyl]-6-fluorospiro[isoquinoline-4-(1H),3'-pyrrolidine]-1,2',3,5'(2H)-tetrone

BFI, 2[4-bromo-2-fluorophenyl)methyl]-6-fluorospiro[isoquinoline-4-(1H),3'-pyrrolidine]-1,2',3,5'(2H)-tetrone (C19 H11 Br F2 N2 O4, 449.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
BFI
Formula
C19 H11 Br F2 N2 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

BFI in 2 structures; the first of them:

  • 1PWL · Crystal structure of human Aldose Reductase complexed with NADP and Minalrestat · BFI A320 · binds TRP20, VAL47, TYR48, TRP79, HIS110, TRP111, THR113, PHE115 and 7 more
  • 1PWL · Crystal structure of human aldose reductase complexed with NADP and minalrestat · BFI A320 · binds TRP20, VAL47, TYR48, TRP79, HIS110, TRP111, THR113, PHE115 and 7 more

Residues it binds most

TRP 2, CYS 2, PHE 2, TYR 2, ALA 2, HIS 2, LEU 2, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate

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