Id |
Subject |
Object |
Predicate |
Lexical cue |
T1 |
0-126 |
Sentence |
denotes |
Higher binding affinity of Furin to SARS-CoV-2 spike (S) protein D614G could be associated with higher SARS-CoV-2 infectivity. |
T2 |
127-137 |
Sentence |
denotes |
OBJECTIVE: |
T3 |
138-252 |
Sentence |
denotes |
The coronavirus disease-19 (COVID-19) pandemic has caused an exponential rise in death rates and hospitalizations. |
T4 |
253-375 |
Sentence |
denotes |
The aim of this study was to characterize the D614 G mutation of SARS-CoV-2 S-protein, which may affect viral infectivity. |
T5 |
376-384 |
Sentence |
denotes |
METHODS: |
T6 |
385-510 |
Sentence |
denotes |
The effect of D614 G mutation on the structure and thermodynamic stability of S-protein was analyzed using DynaMut and SCooP. |
T7 |
511-640 |
Sentence |
denotes |
HDOCK and PRODIGY were used to model furin protease binding to the S-protein RARR cleavage site and calculate binding affinities. |
T8 |
641-800 |
Sentence |
denotes |
Molecular dynamic (MD) simulations were used to predict S-protein apo structure, S-protein-furin complex structure, and the free binding energy of the complex. |
T9 |
801-809 |
Sentence |
denotes |
RESULTS: |
T10 |
810-966 |
Sentence |
denotes |
The D614 G mutation in the G clade of SARS-CoV-2 strains introduced structural mobility and decreased thermal stability of S-protein (ΔΔG: -0.086 kcal/mol). |
T11 |
967-1084 |
Sentence |
denotes |
The mutation resulted in a stronger binding affinity (Kd = 1.6 × 10-8) to furin which may enhance S-protein cleavage. |
T12 |
1085-1270 |
Sentence |
denotes |
Results were corroborated by MD simulations demonstrating higher binding energy of furin to S-protein D614 mutant (-61.9 kcal/mol compared with -56.78 kcal/mol for wild-type S-protein). |
T13 |
1271-1283 |
Sentence |
denotes |
CONCLUSIONS: |
T14 |
1284-1460 |
Sentence |
denotes |
The D614 G mutation in the G clade induced the flexibility of S-protein, resulting in increased furin binding which may enhance S-protein cleave and infiltration of host cells. |
T15 |
1461-1534 |
Sentence |
denotes |
As such, SARS-CoV-2 D614 G mutation may result in a more virulent strain. |