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TitleSnapshots of the Catalytic Cycle of the Industrial Enzyme alpha-Amino-epsilon-Caprolactam Racemase (ACLR) Observed Using X-ray Crystallography
Journal, issue, pagesAcs Catalysis, Vol. 7, Page 1045-1048, Year 2017
Publish dateOct 18, 2016 (structure data deposition date)
AuthorsFrese, A. / Sutton, P.W. / Turkenburg, J.P. / Grogan, G.
External linksAcs Catalysis / Search PubMed
MethodsX-ray diffraction
Resolution1.5 - 1.93 Å
Structure data

PDB-5m46:
Alpha-amino epsilon-caprolactam racemase (ACLR) from Rhizobacterium freirei
Method: X-RAY DIFFRACTION / Resolution: 1.62 Å

PDB-5m49:
Alpha-amino epsilon-caprolactam racemase in complex with PLP and D/L alpha amino epsilon-caprolactam (internal aldimine)
Method: X-RAY DIFFRACTION / Resolution: 1.51 Å

PDB-5m4b:
Alpha-amino epsilon-caprolactam racemase D210A mutant in complex with PLP and geminal diamine intermediate
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-5m4d:
Alpha-amino epsilon-caprolactam racemase K241A mutant in complex with D-ACL (external aldimine)
Method: X-RAY DIFFRACTION / Resolution: 1.93 Å

Chemicals

ChemComp-PLP:
PYRIDOXAL-5'-PHOSPHATE

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

ChemComp-8F4:
(3~{S})-3-azanylazepan-2-one

ChemComp-7F4:
(3~{R})-3-azanylazepan-2-one

ChemComp-7F7:
[6-methyl-5-oxidanyl-4-[(~{E})-[(3~{R})-2-oxidanylideneazepan-3-yl]iminomethyl]pyridin-3-yl]methyl dihydrogen phosphate

Source
  • rhizobium freirei prf 81 (bacteria)
  • rhizobacter (bacteria)
KeywordsISOMERASE / PLP / racemase

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