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TitleTAS-114, a First-in-Class Dual dUTPase/DPD Inhibitor, Demonstrates Potential to Improve Therapeutic Efficacy of Fluoropyrimidine-Based Chemotherapy.
Journal, issue, pagesMol. Cancer Ther., Vol. 17, Page 1683-1693, Year 2018
Publish dateNov 1, 2016 (structure data deposition date)
AuthorsYano, W. / Yokogawa, T. / Wakasa, T. / Yamamura, K. / Fujioka, A. / Yoshisue, K. / Matsushima, E. / Miyahara, S. / Miyakoshi, H. / Taguchi, J. ...Yano, W. / Yokogawa, T. / Wakasa, T. / Yamamura, K. / Fujioka, A. / Yoshisue, K. / Matsushima, E. / Miyahara, S. / Miyakoshi, H. / Taguchi, J. / Chong, K.T. / Takao, Y. / Fukuoka, M. / Matsuo, K.
External linksMol. Cancer Ther. / PubMed:29748212
MethodsX-ray diffraction
Resolution1.8 Å
Structure data

PDB-5h4j:
Crystal structure of Human dUTPase in complex with N-[(1R)-1-[3-(Cyclopentyloxy)-phenyl]-ethyl]-3-[(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)methoxy]-1-propanesulfonamide
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-FKM:
N-[(1R)-1-[3-(Cyclopentyloxy)-phenyl]-ethyl]-3-[(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)methoxy]-1-propanesulfonamide

ChemComp-ZN:
Unknown entry

ChemComp-IMD:
IMIDAZOLE

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

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / Hydrolase / Hydrolase inhibitor / HYDROLASE-HYDROLASE INHIBITOR complex

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