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Structure paper

TitleMolecular structures of cdc2-like kinases in complex with a new inhibitor chemotype.
Journal, issue, pagesPLoS ONE, Vol. 13, Page e0196761-e0196761, Year 2018
Publish dateFeb 20, 2018 (structure data deposition date)
AuthorsWalter, A. / Chaikuad, A. / Helmer, R. / Loaec, N. / Preu, L. / Ott, I. / Knapp, S. / Meijer, L. / Kunick, C.
External linksPLoS ONE / PubMed:29723265
MethodsX-ray diffraction
Resolution1.45 - 2.02 Å
Structure data

PDB-6ft7:
Crystal structure of CLK3 in complex with compound 8a
Method: X-RAY DIFFRACTION / Resolution: 2.02 Å

PDB-6ft8:
Crystal structure of CLK1 in complex with inhibitor 8g
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-6ft9:
Crystal structure of CLK1 in complex with inhibitor 16
Method: X-RAY DIFFRACTION / Resolution: 1.87 Å

Chemicals

ChemComp-IOD:
IODIDE ION

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-E6Q:
3-phenyl-1~{H}-pyrrolo[3,4-g]indol-8-one

ChemComp-HOH:
WATER

ChemComp-E6T:
3-(3-hydroxyphenyl)-1~{H}-pyrrolo[3,4-g]indol-8-one

ChemComp-NA:
Unknown entry

ChemComp-CL:
Unknown entry

ChemComp-E6W:
2-bromanyl-3-phenyl-1~{H}-pyrrolo[3,4-g]indol-8-one

ChemComp-BR:
BROMIDE ION

ChemComp-PO4:
PHOSPHATE ION

ChemComp-GOL:
GLYCEROL

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / kinase / inhibitor / splicing kinase / CLK / Structural Genomics / Structural Genomics Consortium / SGC

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