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Allosteric Mechanisms of Post-translational Modification Regulation in Human cGAS Catalytic Activity from Molecular Dynamics Simulations
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Outgoing claims: the papers this work cites, builds on, or argues with.
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LINCS: A linear constraint solver for molecular simulations
inferredcites →https://doi.org/10.1016/0022-2836(71)90324-xopenalex-snapshot
The interpretation of protein structures: Estimation of static accessibility
inferredcites →https://doi.org/10.1016/j.cell.2018.06.026openalex-snapshot
Structure of the Human cGAS–DNA Complex Reveals Enhanced Control of Immune Surveillance
inferredcites →https://doi.org/10.1016/j.cell.2019.01.016openalex-snapshot
Acetylation Blocks cGAS Activity and Inhibits Self-DNA-Induced Autoimmunity
inferredcites →https://doi.org/10.1016/j.celrep.2014.01.003openalex-snapshot
The Cytosolic DNA Sensor cGAS Forms an Oligomeric Complex with DNA and Undergoes Switch-like Conformational Changes in the Activation Loop
inferredcites →https://doi.org/10.1016/j.celrep.2015.09.007openalex-snapshot
Akt Kinase-Mediated Checkpoint of cGAS DNA Sensing Pathway
inferredcites →https://doi.org/10.1016/j.immuni.2016.08.014openalex-snapshot
Sumoylation Promotes the Stability of the DNA Sensor cGAS and the Adaptor STING to Regulate the Kinetics of Response to DNA Virus
inferredcites →https://doi.org/10.1016/j.immuni.2020.05.013openalex-snapshot
Structures and Mechanisms in the cGAS-STING Innate Immunity Pathway
inferredcites →https://doi.org/10.1016/j.molcel.2013.05.022openalex-snapshot
Cyclic GMP-AMP Containing Mixed Phosphodiester Linkages Is An Endogenous High-Affinity Ligand for STING
inferredcites →https://doi.org/10.1016/j.phrs.2009.07.006openalex-snapshot
The physiological and pathophysiological role of PRMT1-mediated protein arginine methylation
inferredcites →https://doi.org/10.1016/j.softx.2015.06.001openalex-snapshot
GROMACS: High performance molecular simulations through multi-level parallelism from laptops to supercomputers
inferredcites →https://doi.org/10.1021/acs.jcim.0c00475openalex-snapshot
New Insights into the Effect of Residue Mutations on the Rotavirus VP1 Function Using Molecular Dynamic Simulations
inferredcites →https://doi.org/10.1021/ci100275aopenalex-snapshot
Assessing the Performance of the MM/PBSA and MM/GBSA Methods. 1. The Accuracy of Binding Free Energy Calculations Based on Molecular Dynamics Simulations
inferredcites →https://doi.org/10.1021/ci500020mopenalex-snapshot
g_mmpbsa —A GROMACS Tool for High-Throughput MM-PBSA Calculations
inferredcites →https://doi.org/10.1021/ct300418hopenalex-snapshot
MMPBSA.py : An Efficient Program for End-State Free Energy Calculations
inferredcites →https://doi.org/10.1021/jp003020wopenalex-snapshot
Structure and Dynamics of the TIP3P, SPC, and SPC/E Water Models at 298 K
inferredcites →https://doi.org/10.1038/nature12305openalex-snapshot
Structural mechanism of cytosolic DNA sensing by cGAS
inferredcites →https://doi.org/10.1038/nature12306openalex-snapshot
cGAS produces a 2′-5′-linked cyclic dinucleotide second messenger that activates STING
inferredcites →https://doi.org/10.1038/ni.3356openalex-snapshot
Glutamylation of the DNA sensor cGAS regulates its binding and synthase activity in antiviral immunity
inferredcites →https://doi.org/10.1038/ni.3558openalex-snapshot
Regulation and function of the cGAS–STING pathway of cytosolic DNA sensing
inferredcites →https://doi.org/10.1038/nmeth.4067openalex-snapshot
CHARMM36m: an improved force field for folded and intrinsically disordered proteins
inferredcites →https://doi.org/10.1038/s41421-020-0162-2openalex-snapshot
Phosphorylation of cGAS by CDK1 impairs self-DNA sensing in mitosis
inferredcites →https://doi.org/10.1038/s41576-019-0151-1openalex-snapshot
DNA sensing by the cGAS–STING pathway in health and disease
inferredcites →https://doi.org/10.1038/s41580-018-0081-3openalex-snapshot
Functions and mechanisms of non-histone protein acetylation
inferredcites →https://doi.org/10.1038/s41586-018-0629-6openalex-snapshot
Nuclear cGAS suppresses DNA repair and promotes tumorigenesis
inferredcites →https://doi.org/10.1039/d0cp05871hopenalex-snapshot
Conformational dynamics is critical for the allosteric inhibition of cGAS upon acetyl-mimic mutations
inferredcites →https://doi.org/10.1063/1.328693openalex-snapshot
Polymorphic transitions in single crystals: A new molecular dynamics method
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Comparison of simple potential functions for simulating liquid water
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Structural basis for cytosolic double-stranded RNA surveillance by human oligoadenylate synthetase 1
inferredcites →https://doi.org/10.1073/pnas.1922330117openalex-snapshot
KAT5 acetylates cGAS to promote innate immune response to DNA virus
inferredcites →https://doi.org/10.1074/mcp.ra120.001981openalex-snapshot
The DNA Sensor cGAS is Decorated by Acetylation and Phosphorylation Modifications in the Context of Immune Signaling
inferredcites →https://doi.org/10.1080/00268977200100031openalex-snapshot
NpT -ensemble Monte Carlo calculations for binary liquid mixtures
inferredcites →https://doi.org/10.1080/00268978300102851openalex-snapshot
Constant pressure molecular dynamics for molecular systems
inferredcites →https://doi.org/10.1080/00268978400101201openalex-snapshot
A molecular dynamics method for simulations in the canonical ensemble
inferredcites →https://doi.org/10.1146/annurev-cellbio-100617-062903openalex-snapshot
Cytoplasmic Mechanisms of Recognition and Defense of Microbial Nucleic Acids
inferredcites →https://doi.org/10.1146/annurev-immunol-032713-120156openalex-snapshot
Innate Immune Sensing and Signaling of Cytosolic Nucleic Acids
inferredcites →https://doi.org/10.1146/annurev-med-052814-023338openalex-snapshot
Importance of Nucleic Acid Recognition in Inflammation and Autoimmunity
inferredcites →https://doi.org/10.1371/journal.pone.0076983openalex-snapshot
Structural and Functional Analyses of DNA-Sensing and Immune Activation by Human cGAS
inferredcites →https://doi.org/10.1371/journal.pone.0112419openalex-snapshot
A Novel Approach of Dynamic Cross Correlation Analysis on Molecular Dynamics Simulations and Its Application to Ets1 Dimer–DNA Complex
inferredcites →https://doi.org/10.1517/17460441.2015.1032936openalex-snapshot
The MM/PBSA and MM/GBSA methods to estimate ligand-binding affinities
inferredcites →https://doi.org/10.2174/1389203715666140327114232openalex-snapshot
A Review of Methods Available to Estimate Solvent-Accessible Surface Areas of Soluble Proteins in the Folded and Unfolded States
inferredcites →https://doi.org/10.3389/fmolb.2017.00087openalex-snapshot
Recent Developments and Applications of the MMPBSA Method
inferredcites →https://doi.org/10.46439/cancerbiology.5.064openalex-snapshot
Targeting the PRMT1-cGAS-STING signaling pathway to enhance the anti-tumor therapeutic efficacy
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