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Structure paper

TitleX-ray Structural Analysis of Plasmodium falciparum Enoyl Acyl Carrier Protein Reductase as a Pathway toward the Optimization of Triclosan Antimalarial Efficacy.
Journal, issue, pagesJ. Biol. Chem., Vol. 282, Page 25436-25444, Year 2007
Publish dateJan 13, 2006 (structure data deposition date)
AuthorsFreundlich, J.S. / Wang, F. / Tsai, H.C. / Kuo, M. / Shieh, H.M. / Anderson, J.W. / Nkrumah, L.J. / Valderramos, J.C. / Yu, M. / Kumar, T.R. ...Freundlich, J.S. / Wang, F. / Tsai, H.C. / Kuo, M. / Shieh, H.M. / Anderson, J.W. / Nkrumah, L.J. / Valderramos, J.C. / Yu, M. / Kumar, T.R. / Valderramos, S.G. / Jacobs, W.R. / Schiehser, G.A. / Jacobus, D.P. / Fidock, D.A. / Sacchettini, J.C.
External linksJ. Biol. Chem. / PubMed:17567585
MethodsX-ray diffraction
Resolution2.1 - 2.8 Å
Structure data

PDB-2foi:
Synthesis, Biological Activity, and X-Ray Crystal Structural Analysis of Diaryl Ether Inhibitors of Malarial Enoyl ACP Reductase.
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

PDB-2nq8:
Malarial enoyl acyl ACP reductase bound with INH-NAD adduct
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

PDB-2ol4:
Crystal structure of plasmodium falciparum enoyl ACP reductase with triclosan reductase
Method: X-RAY DIFFRACTION / Resolution: 2.26 Å

PDB-2oos:
Crystal structure of plasmodium falciparum enoyl ACP reductase with triclosan reductase
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-2op0:
Crystal structure of plasmodium falciparum enoyl ACP reductase with triclosan reductase
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-2op1:
Crystal structure of plasmodium falciparum enoyl ACP reductase with triclosan reductase
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-NAD:
NICOTINAMIDE-ADENINE-DINUCLEOTIDE / NAD*YM

ChemComp-JPA:
4-(2,4-DICHLOROPHENOXY)-2'-METHYLBIPHENYL-3-OL

ChemComp-HOH:
WATER

ChemComp-ZID:
ISONICOTINIC-ACETYL-NICOTINAMIDE-ADENINE DINUCLEOTIDE

ChemComp-JPN:
2-(2,4-DICHLOROPHENOXY)-5-(3-PHENYLPROPYL)PHENOL

ChemComp-JPJ:
2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL

ChemComp-SO4:
SULFATE ION

ChemComp-7PC:
2-[4-(AMINOMETHYL)-2-CHLOROPHENOXY]-5-PYRIDIN-2-YLPHENOL

ChemComp-8PC:
2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN-2-YLMETHYL)PHENOL

Source
  • plasmodium falciparum (malaria parasite P. falciparum)
KeywordsOXIDOREDUCTASE / enoyl reductase / rossmann fold / PfENR; INH; malaria / PfENR / malaria / triclosan analog

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