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Structure paper

TitleEnzymatic Hydroxylation of Aliphatic C-H Bonds by a Mn/Fe Cofactor.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 145, Page 16526-16537, Year 2023
Publish dateJan 17, 2023 (structure data deposition date)
AuthorsPowell, M.M. / Rao, G. / Britt, R.D. / Rittle, J.
External linksJ. Am. Chem. Soc. / PubMed:37471626
MethodsX-ray diffraction
Resolution1.48 - 2.43 Å
Structure data

PDB-8ful:
Heterologous AibH1H2 purified from Lysogeny broth
Method: X-RAY DIFFRACTION / Resolution: 2.29 Å

PDB-8fum:
AibH1H2 metalated with Fe in the presence of Tris
Method: X-RAY DIFFRACTION / Resolution: 1.48 Å

PDB-8fun:
Enzymatically Active, Mn/Fe Metallated Form of AibH1H2
Method: X-RAY DIFFRACTION / Resolution: 2.24 Å

PDB-8fuo:
Fe-bound AibH1H2
Method: X-RAY DIFFRACTION / Resolution: 2.43 Å

Chemicals

ChemComp-FE:
Unknown entry

ChemComp-GOL:
GLYCEROL

ChemComp-MG:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-PG4:
TETRAETHYLENE GLYCOL / precipitant*YM

ChemComp-TRS:
2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL / pH buffer*YM

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-MN:
Unknown entry

Source
  • rhodococcus wratislaviensis nbrc 100605 (bacteria)
KeywordsOXIDOREDUCTASE / alpha aminoisobutyric acid hydroxylase amidohydrolase-like dimetallic / alpha-aminoisobutyric acid hydroxylase amidohydrolase-like fold dimetallic cofactor

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