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Structure paper

TitleStructural Insight Into Maternal Embryonic Leucine Zipper Kinase (Melk) Conformation and Inhibition Towards Structure- Based Drug Design.
Journal, issue, pagesBiochemistry, Vol. 52, Page 6380-, Year 2013
Publish dateApr 30, 2013 (structure data deposition date)
AuthorsCanevari, G. / Re Depaolini, S. / Cucchi, U. / Bertrand, J.A. / Casale, E. / Perrera, C. / Forte, B. / Carpinelli, P. / Felder, E.R.
External linksBiochemistry / PubMed:23914841
MethodsX-ray diffraction
Resolution1.83 - 2.2 Å
Structure data

PDB-4bky:
Crystal structure of unphosphorylated Maternal Embryonic Leucine zipper Kinase (MELK) in complex with pyrrolopyrazole inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.83 Å

PDB-4bkz:
Crystal structure of unphosphorylated Maternal Embryonic Leucine zipper Kinase (MELK) in complex with a benzodipyrazole inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

Chemicals

ChemComp-82B:
3'-{[(4-bromo-1-methyl-1H-pyrrol-2-yl)carbonyl]amino}-N-[(1S)-1-phenyl-2-(pyrrolidin-1-yl)ethyl]-1',4'-dihydro-5'H-spiro[cyclopropane-1,6'-pyrrolo[3,4-c]pyrazole]-5'-carboxamide

ChemComp-UNX:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-1WS:
N-(3-aminopropyl)-8-[(3-fluorophenyl)amino]-2,4,5,7-tetrahydropyrazolo[3,4-e]indazole-3-carboxamide

Source
  • homo sapiens (human)
KeywordsTRANSFERASE

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