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TitleExo-selective intermolecular Diels-Alder reaction by PyrI4 and AbnU on non-natural substrates.
Journal, issue, pagesCommun Chem, Year 2021
Publish dateJan 13, 2021 (structure data deposition date)
AuthorsKashyap, R. / Yerra, N.V. / Oja, J. / Bala, S. / Potuganti, R. / Thota, J.R. / Alla, M. / Pal, D. / Addlagatta, A.
External linksCommun Chem / Search PubMed
MethodsX-ray diffraction
Resolution2 - 2.6 Å
Structure data

PDB-7dvi:
Crystal Structure of AbnU: An exo-specific intermolecular Diels-Alderase
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-7dvk:
PyrI4 in complex with intermolecular Diels-Alder product
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-HOH:
WATER

ChemComp-HOF:
methyl 4-[[(1S,6S)-6-(dimethylcarbamoyl)cyclohex-2-en-1-yl]carbamoyloxymethyl]benzoate

ChemComp-GOL:
GLYCEROL

Source
  • frankia sp. cc1.17 (bacteria)
  • streptomyces rugosporus (bacteria)
KeywordsISOMERASE / Diels ALderase / Diels-Alderase

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