› 7o22

X-ray diffraction
1.8Å resolution

X-ray structure of furin in complex with the guanylhydrazone-based inhibitor 4 (mi359)

Released:
DOI: 10.2210/pdb7o22/pdb
Model geometry
Fit model/data
Data not analysed
PDB entry 7o22 coloured by chain, front view.
PDB entry 7o22 coloured by chain, side view.
PDB entry 7o22 coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
OFF-State-Specific Inhibition of the Proprotein Convertase Furin.
Dahms SO, Haider T, Klebe G, Steinmetzer T, Brandstetter H
OpenAccess logo ACS Chem Biol 16 1692-1700 (2021)
PMID: 34415722

Function and Biology Details

Reaction catalysed: 
Release of mature proteins from their proproteins by cleavage of -Arg-Xaa-Yaa-Arg-|- bonds, where Xaa can be any amino acid and Yaa is Arg or Lys. Releases albumin, complement component C3 and von Willebrand factor from their respective precursors.
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-140840 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Furin Chain: A
Molecule details ›
Chain: A
Length: 480 amino acids
Theoretical weight: 52.11 KDa
Source organism: Homo sapiens
Expression system: Homo sapiens
UniProt:
  • Canonical: P09958 (Residues: 108-574; Coverage: 61%)
Gene names: FUR, FURIN, PACE, PCSK3
Sequence domains:

Ligands and Environments

6 bound ligands:
Ligand CA 3 x CA
Ligand NA 2 x NA
Ligand CL 1 x CL
Ligand DMS 4 x DMS
Ligand NAG 1 x NAG
Ligand UYW 1 x UYW
No modified residues

Experiments and Validation Details

wwPDB Validation report is not available for this entry.
X-ray source: BESSY BEAMLINE 14.2
Spacegroup: P6522
Unit cell:
a: 130.976Å b: 130.976Å c: 155.485Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.17 0.169 0.182
Expression system: Homo sapiens

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Citations

3 review citations

Functional Roles of Furin in Cardio-Cerebrovascular Diseases.
Wichaiyo et al. (2024)
2 more

1 mention without citation

OFF-State-Specific Inhibition of the Proprotein Convertase Furin.
Dahms et al. (2021)

PDB-REDO

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