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Ligand · 59A

59A · N-{[(2S,3S)-3-(ethoxycarbonyl)oxiran-2-yl]carbonyl}-L-isoleucine

59A, N-{[(2S,3S)-3-(ethoxycarbonyl)oxiran-2-yl]carbonyl}-L-isoleucine (C12 H19 N O6, 273.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
59A
Formula
C12 H19 N O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

59A in 2 structures; the first of them:

  • 2DC8 · X-ray crystal structure analysis of bovine spleen cathepsin B-CA059 complex · 59A A590 · binds GLN23, CYS26, GLY27, SER28, CYS29, TRP30, GLY73, GLY74 and 7 more
  • 2DC8 · X-ray crystal structure analysis of bovine spleen cathepsin B-CA059 complex · 59A A590 · binds GLN23, CYS26, GLY27, SER28, CYS29, TRP30, GLY73, GLY74 and 7 more

Residues it binds most

GLY 2, ALA 2, CYS 2, TRP 2, GLN 2, HIS 2, MET 2, SER 2, VAL 2 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion
  • GOL · Glycerol

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