› 5i2f

X-ray diffraction
1.25Å resolution

Human Histidine Triad Nucleotide Binding Protein 1 (hHint1) with bound sulfamide inhibitor Bio-AMS

Released:
DOI: 10.2210/pdb5i2f/pdb
PDB entry 5i2f coloured by chain, front view.
PDB entry 5i2f coloured by chain, side view.
PDB entry 5i2f coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Design, Synthesis, and Characterization of Sulfamide and Sulfamate Nucleotidomimetic Inhibitors of hHint1.
Shah R, Strom A, Zhou A, Maize KM, Finzel BC, Wagner CR
ACS Med Chem Lett 7 780-4 (2016)
PMID: 27563403

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-156024 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Adenosine 5'-monophosphoramidase HINT1 Chains: A, B
Molecule details ›
Chains: A, B
Length: 129 amino acids
Theoretical weight: 14.1 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: P49773 (Residues: 1-126; Coverage: 100%)
Gene names: HINT, HINT1, PKCI1, PRKCNH1
Sequence domains: HIT domain
Structure domains: HIT-like

Ligands and Environments

2 bound ligands:
Ligand EDO 2 x EDO
Ligand BS5 1 x BS5
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 17-ID
Spacegroup: C2
Unit cell:
a: 77.493Å b: 46.314Å c: 64.073Å
α: 90° β: 94.44° γ: 90°
R-values:
R R work R free
0.156 0.155 0.175
Expression system: Escherichia coli

Quick links

Citations

1 review citation

The Many Faces of Histidine Triad Nucleotide Binding Protein 1 (HINT1).
Dillenburg et al. (2023)
4 other articles