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TitleCrystal structure of the Eg5 - K858 complex and implications for structure-based design of thiadiazole-containing inhibitors.
Journal, issue, pagesEur J Med Chem, Vol. 156, Page 641-651, Year 2018
Publish dateApr 3, 2018 (structure data deposition date)
AuthorsTalapatra, S.K. / Tham, C.L. / Guglielmi, P. / Cirilli, R. / Chandrasekaran, B. / Karpoormath, R. / Carradori, S. / Kozielski, F.
External linksEur J Med Chem / PubMed:30031975
MethodsX-ray diffraction
Resolution1.8 - 2.8 Å
Structure data

PDB-6g6y:
Eg5-inhibitor complex
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-6g6z:
Eg5-inhibitor complex
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

Chemicals

ChemComp-ADP:
ADENOSINE-5'-DIPHOSPHATE / ADP, energy-carrying molecule*YM

ChemComp-MG:
Unknown entry

ChemComp-EOK:
(~{N}~{Z})-~{N}-[(5~{S})-4-ethanoyl-5-methyl-5-phenyl-1,3,4-thiadiazolidin-2-ylidene]ethanamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsCELL CYCLE / Eg5 / Kif11 / Eg5-inhibitor

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