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Ligand · AIO

AIO · [(2R)-1-(L-alanyl-L-isoleucyl)pyrrolidin-2-yl]boronic acid

AIO, [(2R)-1-(L-alanyl-L-isoleucyl)pyrrolidin-2-yl]boronic acid (C13 H26 B N3 O4, 299.2 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, the residues it…

Component
AIO
Formula
C13 H26 B N3 O4
Class
ligand
Structures
4
PDB entries
2

Binding sites

AIO in 4 structures; the first of them:

  • 2EEP · Prolyl Tripeptidyl Aminopeptidase Complexed with an Inhibitor · AIO A801 · binds GLN203, GLU205, TYR518, HIS522, SER603, TYR604, VAL629, TRP632 and 6 more
  • 2Z3Z · Prolyl tripeptidyl aminopeptidase mutant E636A complexd with an inhibitor · AIO A801 · binds GLN203, GLU205, TYR518, PRO521, HIS522, SER603, TYR604, VAL629 and 6 more
  • 2EEP · Prolyl tripeptidyl aminopeptidase complexed with an inhibitor · AIO A801 · binds GLN203, GLU205, TYR518, HIS522, SER603, TYR604, VAL629, TRP632 and 6 more
  • 2Z3Z · Prolyl tripeptidyl aminopeptidase mutant E636A complexd with an inhibitor · AIO A801 · binds GLN203, GLU205, TYR518, PRO521, HIS522, SER603, TYR604, VAL629 and 6 more

Residues it binds most

TYR 4, VAL 4, HIS 4, GLU 4, GLN 4, SER 4, TRP 4, PRO 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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