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Ligand · AJH

AJH · 4-({4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-1,4-diazepan-1-yl}carbonyl)benzoic acid

AJH, 4-({4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-1,4-diazepan-1-yl}carbonyl)benzoic acid (C23 H24 F3 N3 O4, 463.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
AJH
Formula
C23 H24 F3 N3 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

AJH in 2 structures; the first of them:

  • 3EIO · Crystal Structure Analysis of DPPIV Inhibitor · AJH A1 · binds ARG125, GLU205, GLU206, SER209, ARG356, PHE357, TYR547, TYR585 and 9 more
  • 3EIO · Crystal structure analysis of dppiv inhibitor · AJH A1 · binds ARG125, GLU205, GLU206, SER209, ARG356, PHE357, TYR547, TYR585 and 9 more

Residues it binds most

TYR 4, ARG 4, GLU 4, SER 4, VAL 4, ASN 4, HIS 4, PHE 4, TRP 4 (residue and the binding sites it lines).

Found with

  • MAN · alpha-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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