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TitleThe Mechanism of Allosteric Coupling in Choline Kinase A1 Revealed by a Rationally Designed Inhibitor
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 52, Page 4582-, Year 2013
Publish dateFeb 6, 2013 (structure data deposition date)
AuthorsSahun-Roncero, M. / Rubio-Ruiz, B. / Saladino, G. / Conejo-Garcia, A. / Espinosa, A. / Velazquez-Campoy, A. / Gervasio, F.L. / Entrena, A. / Hurtado-Guerrero, R.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:23441033
MethodsX-ray diffraction
Resolution1.9 Å
Structure data

PDB-3zm9:
The mechanism of allosteric coupling in choline kinase a1 revealed by a rationally designed inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

Chemicals

ChemComp-QMQ:
1-(4-(4-(4-((6-amino-9H-purin-9-yl)methyl)phenyl)butyl)benzyl)-4- (dimethylamino)pyridinium

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / NEGATIVE COOPERATIVITY / ALLOSTERIC MECHANISM / ELASTIC NETWORK ANALYSIS

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