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Ligand · A1IBP

A1IBP · ~{N}-[(2~{R})-2-azanyl-2-phenyl-ethyl]-3,5-bis(fluoranyl)-~{N}-methyl-benzenesulfonamide

A1IBP, ~{N}-[(2~{R})-2-azanyl-2-phenyl-ethyl]-3,5-bis(fluoranyl)-~{N}-methyl-benzenesulfonamide (C15 H16 F2 N2 O2 S, 326.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
A1IBP
Formula
C15 H16 F2 N2 O2 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1IBP in 1 structure; the first of them:

  • 9FAZ · Gcase in complex with small molecule inhibitor 1 · A1IBP A612 · binds LEU106, HIS404, ILE407, THR408, LEU411, TYR412, LEU475, ALA477 and 5 more

Residues it binds most

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

Found with

  • K · Potassium ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol
  • PEG · Di(hydroxyethyl)ether

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