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Structure paper

TitleStructure-based discovery of first inhibitors targeting the helicase activity of human PIF1.
Journal, issue, pagesNucleic Acids Res., Vol. 52, Page 12616-12632, Year 2024
Publish dateMay 12, 2024 (structure data deposition date)
AuthorsWever, M.J.A. / Scommegna, F.R. / Egea-Rodriguez, S. / Dehghani-Tafti, S. / Brandao-Neto, J. / Poisson, J.F. / Helfrich, I. / Antson, A.A. / Rodeschini, V. / Bax, B. ...Wever, M.J.A. / Scommegna, F.R. / Egea-Rodriguez, S. / Dehghani-Tafti, S. / Brandao-Neto, J. / Poisson, J.F. / Helfrich, I. / Antson, A.A. / Rodeschini, V. / Bax, B. / Roche, D. / Sanders, C.M.
External linksNucleic Acids Res. / PubMed:39417423
MethodsX-ray diffraction
Resolution1.727 Å
Structure data

PDB-9fb8:
XChem refined PIF1-x0076 complex
Method: X-RAY DIFFRACTION / Resolution: 1.727 Å

PDB-9fi9:
Human PIF + Z48847594 (OCCUPANCY 0.7)
Method: X-RAY DIFFRACTION / Resolution: 1.727 Å

Chemicals

ChemComp-ANP:
PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER / AMP-PNP, energy-carrying molecule analogue*YM

ChemComp-MG:
Unknown entry

ChemComp-O0J:
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]acetamide

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

ChemComp-HOH:
WATER

ChemComp-NA:
Unknown entry

Source
  • homo sapiens (human)
KeywordsDNA BINDING PROTEIN / Helicase / inhibitor / Complex / XChem / AMPPNP

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