Dynamic allostery highlights the evolutionary differences between the CoV-1 and CoV-2 main proteases
Paul Campitelli, Lu Jin, S. Banu Ozkan
Topics & Concepts
Allosteric regulationFlexibility (engineering)ProteasesCooperativityChemistryProtein dynamicsComputational biologyProteaseSevere acute respiratory syndrome coronavirus 2 (SARS-CoV-2)Molecular dynamicsBiophysicsBiological systemProtein structureBiologyCoronavirus disease 2019 (COVID-19)BiochemistryEnzymeComputational chemistryMathematicsMedicineInfectious disease (medical specialty)DiseaseStatisticsPathologySARS-CoV-2 and COVID-19 ResearchProtein Structure and DynamicsComputational Drug Discovery Methods