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TitleValidation of N-Myristoyltransferase as an Antimalarial Drug Target Using an Integrated Chemical Biology Approach.
Journal, issue, pagesNat. Chem., Vol. 6, Page 112-, Year 2014
Publish dateOct 13, 2012 (structure data deposition date)
AuthorsWright, M.H. / Clough, B. / Rackham, M.D. / Rangachari, K. / Brannigan, J.A. / Grainger, M. / Moss, D.K. / Bottrill, A.R. / Heal, W.P. / Broncel, M. ...Wright, M.H. / Clough, B. / Rackham, M.D. / Rangachari, K. / Brannigan, J.A. / Grainger, M. / Moss, D.K. / Bottrill, A.R. / Heal, W.P. / Broncel, M. / Serwa, R.A. / Brady, D. / Mann, D. / Leatherbarrow, R.J. / Tewari, R. / Wilkinson, A.J. / Holder, A.A. / Tate, E.W.
External linksNat. Chem. / PubMed:24451586
MethodsX-ray diffraction
Resolution1.72 - 1.89 Å
Structure data

PDB-2ync:
Plasmodium vivax N-myristoyltransferase in complex with YnC12-CoA thioester.
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

PDB-2ynd:
Plasmodium vivax N-myristoyltransferase in complex with a pyrazole sulphonamide inhibitor.
Method: X-RAY DIFFRACTION / Resolution: 1.89 Å

PDB-2yne:
Plasmodium vivax N-myristoyltransferase in complex with a benzothiophene inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.72 Å

Chemicals

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-YNC:
TETRADEC-13-YNOIC ACID - COA THIOESTER

ChemComp-SO4:
SULFATE ION

ChemComp-MG:
Unknown entry

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-NHW:
2-oxopentadecyl-CoA

ChemComp-646:
2,6-dichloro-4-(2-piperazin-1-ylpyridin-4-yl)-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzenesulfonamide

ChemComp-YNE:
2-(3-piperidin-4-yloxy-1-benzothiophen-2-yl)-5-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1,3,4-oxadiazole

Source
  • plasmodium vivax (malaria parasite P. vivax)
KeywordsTRANSFERASE / MYRISTOYLATION / MALARIA / PYRAZOLE SULPHONAMIDE

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