› 4wuv

X-ray diffraction
1.55Å resolution

Crystal Structure of a putative D-Mannonate oxidoreductase from Haemophilus influenza (Avi_5165, TARGET EFI-513796) with bound NAD

Released:
DOI: 10.2210/pdb4wuv/pdb
PDB 4wuv coloured by chain and viewed from the front.
PDB 4wuv coloured by chain and viewed from the side.
PDB 4wuv coloured by chain and viewed from the top.
Source organism: Haemophilus influenzae RdAW
Entry authors: Yadava U, Vetting MW, Al Obaidi NF, Toro R, Morisco LL, Benach J, Wasserman SR, Attonito JD, Scott Glenn A, Chamala S, Chowdhury S, Lafleur J, Love J, Seidel RD, Whalen KL, Gerlt JA, Almo SC

Function and Biology Details

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

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
2-hydroxycyclohexanecarboxyl-CoA dehydrogenase Chains: A, B
Molecule details ›
Chains: A, B
Length: 307 amino acids
Theoretical weight: 33.77 KDa
Source organism: Haemophilus influenzae RdAW
Expression system: Escherichia coli BL21(DE3)
Structure domains: NAD(P)-binding Rossmann-like Domain

Ligands and Environments

2 bound ligands:
Ligand NAD 2 x NAD
Ligand EDO 4 x EDO
1 modified residue:
Ligand MSE 12 x MSE

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 31-ID
Spacegroup: C2221
Unit cell:
a: 67.976Å b: 138.382Å c: 115.942Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.142 0.141 0.172
Expression system: Escherichia coli BL21(DE3)

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