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Structure paper

TitleReplace: A Strategy for Iterative Design of Cyclin- Binding Groove Inhibitors
Journal, issue, pagesChembiochem, Vol. 7, Page 1909-, Year 2006
Publish dateMar 2, 2007 (structure data deposition date)
AuthorsAndrews, M.J. / Kontopidis, G. / Mcinnes, C. / Plater, A. / Innes, L. / Cowan, A. / Jewsbury, P. / Fischer, P.M.
External linksChembiochem / PubMed:17051658
MethodsX-ray diffraction
Resolution2.06 - 2.6 Å
Structure data

PDB-2uue:
REPLACE: A strategy for Iterative Design of Cyclin Binding Groove Inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.06 Å

PDB-2v22:
REPLACE: A strategy for Iterative Design of Cyclin Binding Groove Inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-MTZ:
4-METHYL-5-{(2E)-2-[(4-MORPHOLIN-4-YLPHENYL)IMINO]-2,5-DIHYDROPYRIMIDIN-4-YL}-1,3-THIAZOL-2-AMINE

ChemComp-GVC:
1-(3,5-DICHLOROPHENYL)-5-METHYL-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID

ChemComp-HOH:
WATER

ChemComp-C35:
N~2~-{[1-(4-CHLOROPHENYL)-5-METHYL-1H-1,2,4-TRIAZOL-3-YL]CARBONYL}-N~5~-(DIAMINOMETHYLIDENE)-L-ORNITHYL-L-LEUCYL-L-ISOLEUCYL-4-FLUORO-L-PHENYLALANINAMIDE

Source
  • homo sapiens (human)
  • synthetic construct (others)
KeywordsTRANSFERASE/INHIBITOR / POLYMORPHISM / CYCLIN GROOVE / CELL DIVISION / CDK2 / KINASE / CYCLIN / ACTIVE / MITOSIS / INHIBITION / PHOSPHORYLATION / NUCLEOTIDE-BINDING / SERINE/THREONINE-PROTEIN KINASE / CELL CYCLE / NONPEPTIDE / TRANSFERASE / ATP-BINDING / TRANSFERASE-INHIBITOR complex

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