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Ligand · A1IBI

A1IBI · (2~{S})-1-(2,6-dimethylphenoxy)propan-2-amine

A1IBI, (2~{S})-1-(2,6-dimethylphenoxy)propan-2-amine (C11 H17 N O, 179.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
A1IBI
Formula
C11 H17 N O
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1IBI in 1 structure; the first of them:

  • 9F9Z · Gcase in complex with small molecule inhibitor 1 · A1IBI A704 · binds LEU106, LEU475, ALA477, ASN481, ASP482, LEU483, ASP484, ALA485

Residues it binds most

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

Found with

  • K · Potassium ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion

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