› 5llz

X-ray diffraction
1.14Å resolution

Dehaloperoxidase B from Amphitrite ornata: benzotriazole complex

Released:
DOI: 10.2210/pdb5llz/pdb
PDB 5llz coloured by chain and viewed from the front.
PDB 5llz coloured by chain and viewed from the side.
PDB 5llz coloured by chain and viewed from the top.
Source organism: Amphitrite ornata
Entry authors: Chicano TM, Dworkowski FSN, Hough MA

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
GLOBIN domain-containing protein Chains: A, B
Molecule details ›
Chains: A, B
Length: 137 amino acids
Theoretical weight: 15.41 KDa
Source organism: Amphitrite ornata
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: Q9NAV7 (Residues: 2-138; Coverage: 99%)
Sequence domains: Globin
Structure domains: Globins

Ligands and Environments

3 bound ligands:
Ligand HEM 2 x HEM
Ligand SO4 5 x SO4
Ligand 0CT 1 x 0CT
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: DIAMOND BEAMLINE I04-1
Spacegroup: P212121
Unit cell:
a: 60.68Å b: 67.07Å c: 69.01Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.145 0.144 0.179
Expression system: Escherichia coli BL21(DE3)

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