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Structure paper

TitleDiscovery and optimization of isoliquiritigenin as a death-associated protein kinase 1 inhibitor.
Journal, issue, pagesEur. J. Med. Chem., Vol. 279, Page 116836-116836, Year 2024
Publish dateJul 8, 2024 (structure data deposition date)
AuthorsYokoyama, T. / Hisatomi, K. / Oshima, S. / Tanaka, I. / Okada, T. / Toyooka, N.
External linksEur. J. Med. Chem. / PubMed:39243455
MethodsX-ray diffraction
Resolution1.52 - 1.72 Å
Structure data

PDB-9inv:
Crystal structure of DAPK1 in complex with isoliquiritigenin
Method: X-RAY DIFFRACTION / Resolution: 1.61 Å

PDB-9inw:
Crystal structure of DAPK1 in complex with compound 9
Method: X-RAY DIFFRACTION / Resolution: 1.52 Å

PDB-9inx:
Crystal structure of DAPK1 in complex with compound 10
Method: X-RAY DIFFRACTION / Resolution: 1.72 Å

Chemicals

ChemComp-HCC:
2',4,4'-TRIHYDROXYCHALCONE

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER


PDB Unreleased entry

PDB-1l2v: SOLUTION STRUCTURE OF A CALMODULIN DIMER IN COMPLEX WITH THE CALMODULIN-BINDING DOMAIN OF THE BASIC-HELIX-LOOP-HELIX TRANSCRIPTION FACTOR SEF2-1

PDB-1l2w:
Crystal Structure of the Yersinia Virulence Effector YopE Chaperone-binding Domain in Complex with its Secretion Chaperone, SycE

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / DAPK1 / kinase / inhibitor / isoliquiritigenin

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