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TitleBisubstrate analog inhibitors of 6-hydroxymethyl-7,8-dihydropterin pyrophosphokinase: New lead exhibits a distinct binding mode.
Journal, issue, pagesBioorg. Med. Chem., Vol. 20, Page 4303-4309, Year 2012
Publish dateMay 16, 2012 (structure data deposition date)
AuthorsShi, G. / Shaw, G. / Li, Y. / Wu, Y. / Yan, H. / Ji, X.
External linksBioorg. Med. Chem. / PubMed:22727779
MethodsX-ray diffraction
Resolution1.73 Å
Structure data

PDB-4f7v:
Crystal structure of E. coli HPPK in complex with bisubstrate analogue inhibitor J1D (HP26)
Method: X-RAY DIFFRACTION / Resolution: 1.73 Å

Chemicals

ChemComp-J1D:
5'-{[2-({N-[(2-amino-7,7-dimethyl-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)carbonyl]glycyl}amino)ethyl]sulfonyl}-5'-deoxyadenosine

ChemComp-HOH:
WATER

Source
  • escherichia coli (E. coli)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / alpha beta / pyrophosphokinase / pyrophosphoryl transfer / TRANSFERASE-TRANSFERASE INHIBITOR complex

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