› 4kii

X-ray diffraction
1.85Å resolution

Beta-lactoglobulin in complex with Cp*Rh(III)Cl N,N-di(pyridin-2-yl)dodecanamide

Released:
DOI: 10.2210/pdb4kii/pdb
PDB 4kii coloured by chain and viewed from the front.
PDB 4kii coloured by chain and viewed from the side.
PDB 4kii coloured by chain and viewed from the top.
Source organism: Bos taurus
Primary publication:
Structural Basis for Enantioselectivity in the Transfer Hydrogenation of a Ketone Catalyzed by an Artificial Metalloenzyme
Cherrier MV, Amara P, Engilberge S, Chevalley A, Salmain M, Fontecilla-Camps JC
Eur. J. inorg. Chem. 21 3596-3600 (2013)

Function and Biology Details

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

Structure analysis Details

Assembly composition:
monomeric (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Beta-lactoglobulin Chain: A
Molecule details ›
Chain: A
Length: 162 amino acids
Theoretical weight: 18.39 KDa
Source organism: Bos taurus
UniProt:
  • Canonical: P02754 (Residues: 17-178; Coverage: 100%)
Gene name: LGB
Sequence domains: Lipocalin / cytosolic fatty-acid binding protein family
Structure domains: Lipocalin

Ligands and Environments

1 bound ligand:
Ligand RHL 1 x RHL
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: ESRF BEAMLINE ID29
Spacegroup: P3221
Unit cell:
a: 52.95Å b: 52.95Å c: 110.68Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.191 0.187 0.22

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