Site Density Functional Theory and Structural Bioinformatics Analysis of the SARS-CoV Spike Protein and hACE2 Complex
Article
[키워드] 3DRISM
Analysis
angiotensin-converting enzyme 2
bind
binding
bioinformatics
cause
cellular membrane
classical
complex
complexes
conformational
conformational change
conformational dynamics
coronavirus
COVID-19
density
distribution
domain
exhibit
functional
glycoprotein
H-bond
hACE2
homotrimer
human host cell
Inclusion
increase
indicate
Interaction
interaction site
interactions
intermolecular interaction
Modification
normal mode analysis
promote
Proteolytic processing
RBD
RBD-ACE2
receptor
S protein
SARS-CoV spike
SARS-CoV-1
SARS-CoV-2
SARS-CoV-2 S
SARS-CoV-2 spike protein
shown
Site
site density functional theory
spike protein binding to human receptor
structural rigidity
Structure
the RBD
the S protein
the SARS-CoV-2
the spike protein
theory
[DOI] 10.3390/molecules27030799 PMC 바로가기 [Article Type] Article
[DOI] 10.3390/molecules27030799 PMC 바로가기 [Article Type] Article