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Structure paper

TitleStructural and Computational Bases for Dramatic Skeletal Rearrangement in Anditomin Biosynthesis.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 140, Page 9743-9750, Year 2018
Publish dateApr 1, 2018 (structure data deposition date)
AuthorsNakashima, Y. / Mitsuhashi, T. / Matsuda, Y. / Senda, M. / Sato, H. / Yamazaki, M. / Uchiyama, M. / Senda, T. / Abe, I.
External linksJ. Am. Chem. Soc. / PubMed:29972643
MethodsX-ray diffraction
Resolution1.95 - 2.5 Å
Structure data

PDB-5zm2:
Fe(II)/(alpha)ketoglutarate-dependent dioxygenase AndA
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

PDB-5zm3:
Fe(II)/(alpha)ketoglutarate-dependent dioxygenase AndA with preandiloid B
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

PDB-5zm4:
Fe(II)/(alpha)ketoglutarate-dependent dioxygenase AndA with preandiloid C
Method: X-RAY DIFFRACTION / Resolution: 1.95 Å

Chemicals

ChemComp-HOH:
WATER

ChemComp-FE:
Unknown entry

ChemComp-AKG:
2-OXOGLUTARIC ACID

ChemComp-9FR:
(6aS,8aR,12aS,12bR,13aR)-5,6a,9,9,12a,13a-hexamethyl-7,8,8a,9,11,12,12a,12b,13,13a-decahydro-3H-benzo[a]furo[3,4-j]xanthene-3,4,10(1H,6aH)-trione

ChemComp-9FU:
(6aS,8aR,12aS,12bR,13aR)-5,6a,9,9,12a,13a-hexamethyl-7,8,8a,9,12a,12b,13,13a-octahydro-3H-benzo[a]furo[3,4-j]xanthene-3,4,10(1H,6aH)-trione

Source
  • emericella variicolor (mold)
KeywordsOXIDOREDUCTASE / Oxygenase

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