Dimerization of the p53 Oligomerization Domain: Identification of a Folding Nucleus by Molecular Dynamics Simulations

Dimerization of the p53 oligomerization domain involves coupled folding and binding of monomers. To examine the dimerization, we have performed molecular dynamics (MD) simulations of dimer folding from the rate-limiting transition state ensemble (TSE). Among 799 putative transition state structures...

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Veröffentlicht in:	Journal of molecular biology 2005-01, Vol.345 (4), p.869-878
Hauptverfasser:	Chong, Lillian T., Snow, Christopher D., Rhee, Young Min, Pande, Vijay S.
Format:	Artikel
Sprache:	eng
Schlagworte:	Computer Simulation Dimerization Models, Molecular molecular dynamics simulation oligomerization Protein Folding protein interactions Protein Structure, Quaternary Protein Structure, Tertiary Reproducibility of Results Temperature Thermodynamics tumor suppressor p53 Tumor Suppressor Protein p53 - chemistry Tumor Suppressor Protein p53 - metabolism
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