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Ligand · A1IBQ

A1IBQ · ~{N}-[(2~{S})-2-azanyl-2-phenyl-ethyl]-3,5-bis(fluoranyl)benzenesulfonamide

A1IBQ, ~{N}-[(2~{S})-2-azanyl-2-phenyl-ethyl]-3,5-bis(fluoranyl)benzenesulfonamide (C14 H14 F2 N2 O2 S, 312.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5…

Component
A1IBQ
Formula
C14 H14 F2 N2 O2 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1IBQ in 1 structure; the first of them:

  • 9FAL · Gcase in complex with small molecule inhibitor 1 · A1IBQ A606 · binds HIS404, ILE407, THR408, LEU411, TYR412, ASN481, ASP482, LEU483 and 3 more

Residues it binds most

ASP 1, LEU 1, ALA 1, ARG 1, ASN 1, HIS 1, ILE 1, THR 1, TYR 1 (residue and the binding sites it lines).

Found with

  • BAQ · pyrrolidin-2-one
  • K · Potassium ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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