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Structure paper

TitleX-ray Structures of two xanthine inhibitors bound to PEPCK and N-3 modifications of substituted 1,8-Dibenzylxanthines
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 13, Page 3871-3874, Year 2003
Publish dateJul 6, 2002 (structure data deposition date)
AuthorsFoley, L.H. / Wang, P. / Dunten, P. / Ramsey, G. / Gubler, M.-L. / Wertheimer, S.J.
External linksBioorg. Med. Chem. Lett. / PubMed:14552798
MethodsX-ray diffraction
Resolution2.1 - 2.25 Å
Structure data

PDB-1m51:
PEPCK complex with a GTP-competitive inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

PDB-1nhx:
PEPCK COMPLEX WITH A GTP-COMPETITIVE INHIBITOR
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-MN:
Unknown entry

ChemComp-ACT:
ACETATE ION

ChemComp-TSX:
N-[4-(1-ALLYL-3-BUTYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YLMETHYL)-PHENYL]-ACETAMIDE

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

ChemComp-NA:
Unknown entry

ChemComp-PEP:
PHOSPHOENOLPYRUVATE

ChemComp-FTB:
N-{4-[1-(2-FLUOROBENZYL)-3-BUTYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YLMETHYL]-PHENYL}-ACETAMIDE

Source
  • homo sapiens (human)
KeywordsLYASE / gluconeogenesis / xanthine / inhibitor

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