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TitleSynthetic and Crystallographic Studies of a New Inhibitor Series Targeting Bacillus anthracis Dihydrofolate Reductase
Journal, issue, pagesJ. Med. Chem., Vol. 51, Page 7532-7540, Year 2008
Publish dateJul 31, 2008 (structure data deposition date)
AuthorsBeierlein, J.M. / Frey, K.M. / Bolstad, D.B. / Pelphrey, P.M. / Joska, T.M. / Smith, A.E. / Priestley, N.D. / Wright, D.L. / Anderson, A.C.
External linksJ. Med. Chem. / PubMed:19007108
MethodsX-ray diffraction
Resolution2.25 Å
Structure data

PDB-3e0b:
Bacillus anthracis Dihydrofolate Reductase complexed with NADPH and 2,4-diamino-5-(3-(2,5-dimethoxyphenyl)prop-1-ynyl)-6-ethylpyrimidine (UCP120B)
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

Chemicals

ChemComp-NDP:
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-N22:
5-[3-(2,5-dimethoxyphenyl)prop-1-yn-1-yl]-6-ethylpyrimidine-2,4-diamine

ChemComp-HOH:
WATER

Source
  • bacillus anthracis (anthrax bacterium)
KeywordsOXIDOREDUCTASE

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