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Structure paper

TitleMutational Biosynthesis of Hitachimycin Analogs Controlled by the beta-Amino Acid-Selective Adenylation Enzyme HitB.
Journal, issue, pagesAcs Chem. Biol., Vol. 16, Page 539-547, Year 2021
Publish dateDec 22, 2020 (structure data deposition date)
AuthorsKudo, F. / Takahashi, S. / Miyanaga, A. / Nakazawa, Y. / Nishino, K. / Hayakawa, Y. / Kawamura, K. / Ishikawa, F. / Tanabe, G. / Iwai, N. ...Kudo, F. / Takahashi, S. / Miyanaga, A. / Nakazawa, Y. / Nishino, K. / Hayakawa, Y. / Kawamura, K. / Ishikawa, F. / Tanabe, G. / Iwai, N. / Nagumo, Y. / Usui, T. / Eguchi, T.
External linksAcs Chem. Biol. / PubMed:33625847
MethodsX-ray diffraction
Resolution2.45 - 2.6 Å
Structure data

PDB-7dq5:
Crystal structure of HitB in complex with (S)-beta-phenylalanine sulfamoyladenosine
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

PDB-7dq6:
Crystal structure of HitB in complex with (S)-beta-3-Br-phenylalanine sulfamoyladenosine
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-8PZ:
[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl ~{N}-[(3~{S})-3-azanyl-3-phenyl-propanoyl]sulfamate

ChemComp-CA:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-HFR:
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl N-[(3S)-3-azanyl-3-(3-bromophenyl)propanoyl]sulfamate

Source
  • embleya scabrispora (bacteria)
KeywordsLIGASE / Hitachimycin / Polyketide biosynthesis / ATP binding / Adenylation

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