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TitleSynthesis and structure-activity relationships of soluble 8-substituted 4-(2-chlorophenyl)-9-hydroxypyrrolo[3,4-c]carbazole-1,3(2H,6H)-diones as inhibitors of the Wee1 and Chk1 checkpoint kinases.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 18, Page 929-933, Year 2008
Publish dateNov 29, 2007 (structure data deposition date)
AuthorsSmaill, J.B. / Lee, H.H. / Palmer, B.D. / Thompson, A.M. / Squire, C.J. / Baker, E.N. / Booth, R.J. / Kraker, A. / Hook, K. / Denny, W.A.
External linksBioorg. Med. Chem. Lett. / PubMed:18191399
MethodsX-ray diffraction
Resolution2.2 Å
Structure data

PDB-3bi6:
Wee1 kinase complex with inhibitor PD352396
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-3biz:
Wee1 kinase complex with inhibitor PD331618
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

Chemicals

ChemComp-CL:
Unknown entry

ChemComp-396:
4-(2-chlorophenyl)-9-hydroxy-6-methyl-1,3-dioxo-N-(2-pyrrolidin-1-ylethyl)pyrrolo[3,4-g]carbazole-8-carboxamide

ChemComp-HOH:
WATER

ChemComp-61E:
4-(2-chlorophenyl)-8-[3-(dimethylamino)propoxy]-9-hydroxy-6-methylpyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / kinase domain / inhibitor complex / ATP-binding / Cell cycle / Cell division / Magnesium / Metal-binding / Mitosis / Nucleotide-binding / Nucleus / Phosphoprotein / Tyrosine-protein kinase / Ubl conjugation

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