Constrained catecholamines gain β2AR selectivity through allosteric effects on pocket dynamics
Published 2023 View Full Article
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Title
Constrained catecholamines gain β2AR selectivity through allosteric effects on pocket dynamics
Authors
Keywords
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Journal
Nature Communications
Volume 14, Issue 1, Pages -
Publisher
Springer Science and Business Media LLC
Online
2023-04-14
DOI
10.1038/s41467-023-37808-y
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- (2020) Jan Hellmann et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
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- (2019) H.C. Stephen Chan et al. TRENDS IN BIOCHEMICAL SCIENCES
- ZOO: an automatic data-collection system for high-throughput structure analysis in protein microcrystallography
- (2019) Kunio Hirata et al. Acta Crystallographica Section D-Structural Biology
- Hybridization of β-Adrenergic Agonists and Antagonists Confers G Protein Bias
- (2019) Markus Stanek et al. JOURNAL OF MEDICINAL CHEMISTRY
- Molecular basis for high-affinity agonist binding in GPCRs
- (2019) Tony Warne et al. SCIENCE
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- (2018) Krishna Sriram et al. MOLECULAR PHARMACOLOGY
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- (2018) Terry Kenakin et al. TRENDS IN PHARMACOLOGICAL SCIENCES
- KAMO: towards automated data processing for microcrystals
- (2018) Keitaro Yamashita et al. Acta Crystallographica Section D-Structural Biology
- Structure-guided development of selective M3 muscarinic acetylcholine receptor antagonists
- (2018) Hongtao Liu et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- Purinergic Receptor Transactivation by the β 2 -Adrenergic Receptor Increases Intracellular Ca 2+ in Nonexcitable Cells
- (2017) Wayne Stallaert et al. MOLECULAR PHARMACOLOGY
- Structure-inspired design of β-arrestin-biased ligands for aminergic GPCRs
- (2017) John D McCorvy et al. Nature Chemical Biology
- Red fluorescent protein-based cAMP indicator applicable to optogenetics and in vivo imaging
- (2017) Kazuki Harada et al. Scientific Reports
- Allosteric coupling from G protein to the agonist-binding pocket in GPCRs
- (2016) Brian T. DeVree et al. NATURE
- CHARMM36m: an improved force field for folded and intrinsically disordered proteins
- (2016) Jing Huang et al. NATURE METHODS
- Structure-guided development of heterodimer-selective GPCR ligands
- (2016) Harald Hübner et al. Nature Communications
- Long-Time-Step Molecular Dynamics through Hydrogen Mass Repartitioning
- (2015) Chad W. Hopkins et al. Journal of Chemical Theory and Computation
- Beta-Blockers: Current State of Knowledge and Perspectives
- (2015) Magdalena Ogrodowczyk et al. MINI-REVIEWS IN MEDICINAL CHEMISTRY
- Insights into the Role of Asp792.50 in β2 Adrenergic Receptor Activation from Molecular Dynamics Simulations
- (2014) Anirudh Ranganathan et al. BIOCHEMISTRY
- PTRAJ and CPPTRAJ: Software for Processing and Analysis of Molecular Dynamics Trajectory Data
- (2013) Daniel R. Roe et al. Journal of Chemical Theory and Computation
- CHARMM36 all-atom additive protein force field: Validation based on comparison to NMR data
- (2013) Jing Huang et al. JOURNAL OF COMPUTATIONAL CHEMISTRY
- Adrenaline-activated structure of β2-adrenoceptor stabilized by an engineered nanobody
- (2013) Aaron M. Ring et al. NATURE
- Inclusion of Many-Body Effects in the Additive CHARMM Protein CMAP Potential Results in Enhanced Cooperativity of α-Helix and β-Hairpin Formation
- (2012) Robert B. Best et al. BIOPHYSICAL JOURNAL
- Automation of the CHARMM General Force Field (CGenFF) II: Assignment of Bonded Parameters and Partial Atomic Charges
- (2012) K. Vanommeslaeghe et al. Journal of Chemical Information and Modeling
- Automation of the CHARMM General Force Field (CGenFF) I: Bond Perception and Atom Typing
- (2012) K. Vanommeslaeghe et al. Journal of Chemical Information and Modeling
- Optimization of the Additive CHARMM All-Atom Protein Force Field Targeting Improved Sampling of the Backbone ϕ, ψ and Side-Chain χ1 and χ2 Dihedral Angles
- (2012) Robert B. Best et al. Journal of Chemical Theory and Computation
- Overview of theCCP4 suite and current developments
- (2011) Martyn D. Winn et al. ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY
- Structure and function of an irreversible agonist-β2 adrenoceptor complex
- (2011) Daniel M. Rosenbaum et al. NATURE
- Pathway and mechanism of drug binding to G-protein-coupled receptors
- (2011) Ron O. Dror et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- PHENIX: a comprehensive Python-based system for macromolecular structure solution
- (2010) Paul D. Adams et al. ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY
- Update of the CHARMM All-Atom Additive Force Field for Lipids: Validation on Six Lipid Types
- (2010) Jeffery B. Klauda et al. JOURNAL OF PHYSICAL CHEMISTRY B
- MolProbity: all-atom structure validation for macromolecular crystallography
- (2009) Vincent B. Chen et al. ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY
- Enzymatic assembly of DNA molecules up to several hundred kilobases
- (2009) Daniel G Gibson et al. NATURE METHODS
- Crystallizing membrane proteins using lipidic mesophases
- (2009) Martin Caffrey et al. Nature Protocols
- Identification of two distinct inactive conformations of the 2-adrenergic receptor reconciles structural and biochemical observations
- (2009) R. O. Dror et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
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