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› 2qqt

X-ray diffraction
2.5Å resolution

Crystal structure of the complex of bovine lactoperoxidase with acetyl salicylic acid at 2.5 A resolution

Released:
DOI: 10.2210/pdb2qqt/pdb
PDB entry 2qqt coloured by chain, front view.
PDB entry 2qqt coloured by chain, side view.
PDB entry 2qqt coloured by chain, top view.
Source organism: Bos taurus
Entry authors: Singh AK, Singh N, Sharma S, Kaur P, Singh TP

Function and Biology Details

Reaction catalysed: 
[2 a phenolic donor + H2O2 = 2 a phenolic radical donor + 2 H2O.]
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-160329 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecules (3 distinct):
Lactoperoxidase Chain: A
Molecule details ›
Chain: A
Length: 595 amino acids
Theoretical weight: 67.85 KDa
Source organism: Bos taurus
UniProt:
  • Canonical: P80025 (Residues: 118-712; Coverage: 86%)
Gene name: LPO
Sequence domains: Animal haem peroxidase
Structure domains: Haem peroxidase domain superfamily, animal type

Ligands and Environments


Cofactor: Ligand HEM 1 x HEM
Carbohydrate polymer : NEW Components: NAG, MAN
Carbohydrate polymer
Carbohydrate polymer : NEW Components: NAG
Carbohydrate polymer
4 bound ligands:
Ligand AIN 1 x AIN
Ligand CA 1 x CA
Ligand SCN 1 x SCN
Ligand IOD 7 x IOD
1 modified residue:
Ligand SEP 1 x SEP

Experiments and Validation Details

Entry percentile scores
X-ray source: RIGAKU RU300
Spacegroup: P21
Unit cell:
a: 54.66Å b: 80.52Å c: 77.97Å
α: 90° β: 102.65° γ: 90°
R-values:
R R work R free
0.2 0.194 0.211

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