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TitleStructural analysis of human dihydrofolate reductase as a binary complex with the potent and selective inhibitor 2,4-diamino-6-{2'-O-(3-carboxypropyl)oxydibenz[b,f]-azepin-5-yl}methylpteridine reveals an unusual binding mode.
Journal, issue, pagesActa Crystallogr. ,Sect. D, Vol. 67, Page 875-880, Year 2011
Publish dateMay 26, 2011 (structure data deposition date)
AuthorsCody, V. / Pace, J. / Nowak, J.
External linksActa Crystallogr. ,Sect. D / PubMed:21931219
MethodsX-ray diffraction
Resolution1.8 Å
Structure data

PDB-3s7a:
Human dihydrofolate reductase binary complex with PT684
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-684:
4-({5-[(2,4-diaminopteridin-6-yl)methyl]-5H-dibenzo[b,f]azepin-2-yl}oxy)butanoic acid

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / single polypeptide chain / reductase / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex

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