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Email: shafiqulhasan8097@gmail.com
Presentation by
Shafiqul Islam
Research Assistant
Red Green Research Centre
Impact of Highly Mutated SNP in the SARS-CoV-2
ORF8 Protein: Insight from Microsecond Molecular
Dynamics Simulation Study
Background
ORF1a ORF1b S ORF3 E M ORF6 ORF7 ORF8 N
ORF
10
5’ 3’
o A unique accessory protein of SARS-
CoV family
o Origin of SARS-CoV-2 ORF8 protein
o Diverse roles in Coronaviruses
pathobiology
o Acting as a type1 interferon signaling
pathway inhibition
o Its believed that ORF8 functioning as a
immune modulator, ER protein quality
control and viral trafficking
Objective
 The main objective of the study is to reveal the conformational
behavior of the native and hyper-variable mutant of SARS-CoV-2
ORF8 protein through long Molecular dynamics simulation
 Also identifies the major crucial residues responsible for the
formation of ORF8 homodimer interface
Work Flow
SARS-CoV-2 0RF8 Protein
ORF8 Protein Sequences
from UniportKb
Literature
review
Analysis of GISAID Database
for hyper-variable residue
Homology modeling of
native and mutants
Structure Visualization
by Chimera X
Refinement by
YASARA
Model quality
assessment
Molecular dynamics
simulation on native and
mutants
Analysis of t-test on RMSD,
RG, SASA and RMSF
Principle component analysis
Per-residue wise Secondary
structure analysis
MM/GBSA Calculation
Native and
mutants dimer
interface and
interacting
residues analysis
by PDB sum

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ORF8 Presentation.pptx

  • 1. Email: shafiqulhasan8097@gmail.com Presentation by Shafiqul Islam Research Assistant Red Green Research Centre Impact of Highly Mutated SNP in the SARS-CoV-2 ORF8 Protein: Insight from Microsecond Molecular Dynamics Simulation Study
  • 2. Background ORF1a ORF1b S ORF3 E M ORF6 ORF7 ORF8 N ORF 10 5’ 3’ o A unique accessory protein of SARS- CoV family o Origin of SARS-CoV-2 ORF8 protein o Diverse roles in Coronaviruses pathobiology o Acting as a type1 interferon signaling pathway inhibition o Its believed that ORF8 functioning as a immune modulator, ER protein quality control and viral trafficking
  • 3. Objective  The main objective of the study is to reveal the conformational behavior of the native and hyper-variable mutant of SARS-CoV-2 ORF8 protein through long Molecular dynamics simulation  Also identifies the major crucial residues responsible for the formation of ORF8 homodimer interface
  • 4. Work Flow SARS-CoV-2 0RF8 Protein ORF8 Protein Sequences from UniportKb Literature review Analysis of GISAID Database for hyper-variable residue Homology modeling of native and mutants Structure Visualization by Chimera X Refinement by YASARA Model quality assessment Molecular dynamics simulation on native and mutants Analysis of t-test on RMSD, RG, SASA and RMSF Principle component analysis Per-residue wise Secondary structure analysis MM/GBSA Calculation Native and mutants dimer interface and interacting residues analysis by PDB sum