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TitleIdentification of Acoramidis as a Repurposed Inhibitor of the DNA Sanitization Enzyme MutT Homologue 1.
Journal, issue, pagesAcs Pharmacol Transl Sci, Vol. 9, Page 698-705, Year 2026
Publish dateNov 19, 2025 (structure data deposition date)
AuthorsYokoyama, T. / Nakamura, T. / Goto, M. / Kusaka, K.
External linksAcs Pharmacol Transl Sci / PubMed:41852632
MethodsX-ray diffraction
Resolution1.08 - 1.86 Å
Structure data

PDB-9xri:
Crystal structure of MTH1 in complex with acoramidis bound at the active site and protein-protein interface (molar ratio 1:24)
Method: X-RAY DIFFRACTION / Resolution: 1.08 Å

PDB-9xrj:
Crystal structure of MTH1 in complex with acoramidis
Method: X-RAY DIFFRACTION / Resolution: 1.86 Å

Chemicals

ChemComp-16V:
3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluorobenzoic acid

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE / inhibitor / cancer / NUDIX hydrolase / drug repositioning

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