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Ligand · 1FO

1FO · 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2-yl]-2-hydroxy-4-oxohexa-2,5-dienoic acid

1FO, 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2-yl]-2-hydroxy-4-oxohexa-2,5-dienoic acid (C17 H12 F N O5, 329.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å…

Component
1FO
Formula
C17 H12 F N O5
Class
ligand
Structures
4
PDB entries
2

Binding sites

1FO in 4 structures; the first of them:

  • 4IQT · Tdt core in complex with inhibitor 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2-yl]-2-hydroxy-4-oxoh… · 1FO A601 · binds MET192, THR331, GLY332, GLY333, PHE334, ARG336, THR340, GLY341 and 9 more
  • 4IQV · Tdt core in complex with inhibitor 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2-yl]-2-hydroxy-4-oxoh… · 1FO A602 · binds MET192, LYS199, MET330, THR331, GLY332, GLY333, PHE334, ARG336 and 9 more
  • 4IQT · Tdt core in complex with inhibitor 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2… · 1FO A601 · binds MET192, THR331, GLY332, GLY333, PHE334, ARG336, THR340, GLY341 and 9 more
  • 4IQV · Tdt core in complex with inhibitor 6-[4-(3-fluorobenzoyl)-1H-pyrrol-2… · 1FO A602 · binds MET192, LYS199, MET330, THR331, GLY332, GLY333, PHE334, ARG336 and 9 more

Residues it binds most

GLY 4, ARG 4, ASP 4, MET 4, THR 4, ALA 4, GLN 4, PHE 4, SER 4, VAL 4 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion

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