› 2yb9

X-ray diffraction
2.4Å resolution

Crystal Structure of Human Neutral Endopeptidase complexed with a heteroarylalanine diacid.

Released:
DOI: 10.2210/pdb2yb9/pdb
PDB entry 2yb9 coloured by chain, front view.
PDB entry 2yb9 coloured by chain, side view.
PDB entry 2yb9 coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Synthesis and evaluation of heteroarylalanine diacids as potent and selective neutral endopeptidase inhibitors.
Glossop MS, Bazin RJ, Dack KN, Fox DN, MacDonald GA, Mills M, Owen DR, Phillips C, Reeves KA, Ringer TJ, Strang RS, Watson CA
Bioorg Med Chem Lett 21 3404-6 (2011)
PMID: 21515054

Function and Biology Details

Reaction catalysed: 
Preferential cleavage of polypeptides between hydrophobic residues, particularly with Phe or Tyr at P1'.
Biochemical function:
Biological process:
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-140131 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Neprilysin Chain: A
Molecule details ›
Chain: A
Length: 696 amino acids
Theoretical weight: 79.53 KDa
Source organism: Homo sapiens
Expression system: Saccharomyces cerevisiae
UniProt:
  • Canonical: P08473 (Residues: 55-750; Coverage: 93%)
Gene names: EPN, MME
Sequence domains:
Structure domains:

Ligands and Environments

2 bound ligands:
Ligand ZN 1 x ZN
Ligand HA0 1 x HA0
No modified residues

Experiments and Validation Details

Entry percentile scores
Spacegroup: P3221
Unit cell:
a: 107.841Å b: 107.841Å c: 112.794Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.176 0.172 0.243
Expression system: Saccharomyces cerevisiae

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Citations

1 review citation

Novel Therapeutic Approaches Targeting the Renin-Angiotensin System and Associated Peptides in Hypertension and Heart Failure.
Arendse et al. (2019)
3 other articles

1 mention without citation

Engineering neprilysin activity and specificity to create a novel therapeutic for Alzheimer's disease.
Webster et al. (2014)