› 4oyp

X-ray diffraction
2.28Å resolution

Human solAC Complexed with 1-Benzofuran-2-carboxylic acid

Released:
DOI: 10.2210/pdb4oyp/pdb
PDB entry 4oyp coloured by chain, front view.
PDB entry 4oyp coloured by chain, side view.
PDB entry 4oyp coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Crystal structure of human soluble adenylate cyclase reveals a distinct, highly flexible allosteric bicarbonate binding pocket.
Saalau-Bethell SM, Berdini V, Cleasby A, Congreve M, Coyle JE, Lock V, Murray CW, O'Brien MA, Rich SJ, Sambrook T, Vinkovic M, Yon JR, Jhoti H
ChemMedChem 9 823-32 (2014)
PMID: 24616449

Function and Biology Details

Reaction catalysed: 
ATP = 3',5'-cyclic AMP + diphosphate
Biochemical function:
  • not assigned
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assemblies composition:
monomeric (preferred)
homo trimer
Assembly name:
PDBe Complex ID:
PDB-CPX-188670 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Adenylate cyclase type 10 Chain: A
Molecule details ›
Chain: A
Length: 470 amino acids
Theoretical weight: 53.47 KDa
Source organism: Homo sapiens
Expression system: Spodoptera frugiperda
UniProt:
  • Canonical: Q96PN6 (Residues: 1-469; Coverage: 29%)
Gene names: ADCY10, SAC
Sequence domains: Adenylate and Guanylate cyclase catalytic domain
Structure domains: Nucleotide cyclase

Ligands and Environments

2 bound ligands:
Ligand CL 1 x CL
Ligand BZ2 1 x BZ2
1 modified residue:
Ligand CME 1 x CME

Experiments and Validation Details

Entry percentile scores
X-ray source: ESRF BEAMLINE ID29
Spacegroup: P63
Unit cell:
a: 99.342Å b: 99.342Å c: 97.625Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.167 0.164 0.228
Expression system: Spodoptera frugiperda

Quick links

Citations

7 review citations

International Union of Basic and Clinical Pharmacology. CI. Structures and Small Molecule Modulators of Mammalian Adenylyl Cyclases.
Dessauer et al. (2017)
6 more

1 mention without citation

Crystal structure of human soluble adenylate cyclase reveals a distinct, highly flexible allosteric bicarbonate binding pocket.
Saalau-Bethell et al. (2014)