X-ray structures of general anaesthetics bound to a pentameric ligand-gated ion channel

VMD: visual molecular dynamics

Humphrey, W., Dalke, A., & Schulten, K. (1996) · Journal of Molecular Graphics · doi:10.1016/0263-7855(96)00018-5 · Cited by 66,952

Coot : model-building tools for molecular graphics

Emsley, P., & Cowtan, K. (2004) · Acta Crystallographica Section D Biological Crystallography · doi:10.1107/s0907444904019158 · Cited by 30,571

Particle mesh Ewald: An N⋅log(N) method for Ewald sums in large systems

Darden, T., York, D., & Pedersen, L. (1993) · The Journal of Chemical Physics · doi:10.1063/1.464397 · Cited by 29,638

The PyMOL Molecular Graphics System

DeLano, W. L. (2002) · Medical Entomology and Zoology · Cited by 18,147

The CCP4 suite: programs for protein crystallography

Number Collaborative Computational Project (1994) · Acta Crystallographica Section D Biological Crystallography · doi:10.1107/s0907444994003112 · Cited by 17,317

Scalable molecular dynamics with NAMD

Phillips, J. C., Braun, R., Wang, W., Gumbart, J., Tajkhorshid, E., Villa, E., Chipot, C., Skeel, R. D., Kalé, L., & Schulten, K. (2005) · Journal of Computational Chemistry · doi:10.1002/jcc.20289 · Cited by 16,914

Refinement of Macromolecular Structures by the Maximum-Likelihood Method

Murshudov, G. N., Vagin, A. A., & Dodson, E. J. (1997) · Acta Crystallographica Section D Biological Crystallography · doi:10.1107/s0907444996012255 · Cited by 14,796

All-Atom Empirical Potential for Molecular Modeling and Dynamics Studies of Proteins

MacKerell, A. D., Bashford, D., Bellott, M., Dunbrack, R. L., Evanseck, J. D., Field, M. J., Fischer, S., Gao, J., Guo, H., Ha, S., et al. (1998) · The Journal of Physical Chemistry B · doi:10.1021/jp973084f · Cited by 14,429

PRODRG: a tool for high-throughput crystallography of protein–ligand complexes

Schüttelkopf, A. W., & van Aalten, D. M. F. (2004) · Acta Crystallographica Section D Biological Crystallography · doi:10.1107/s0907444904011679 · Cited by 4,837

MolProbity: all-atom contacts and structure validation for proteins and nucleic acids

Davis, I., Leaver‐Fay, A., Chen, V. B., Block, J. N., Kapral, G. J., Wang, X., Murray, L. W., Arendall, W. B., Snoeyink, J. S., Richardson, J. S., et al. (2007) · Nucleic Acids Research · doi:10.1093/nar/gkm216 · Cited by 3,918

Experimental and theoretical approaches to conscious processing

Dehaene, S., & Changeux, J.-P. (2011) · Neuron · doi:10.1016/j.neuron.2011.03.018 · Cited by 2,573

Crystal structure of a human GABAA receptor

Miller, P. S., & Aricescu, A. R. (2014) · Nature · doi:10.1038/nature13293 · Cited by 734

Allostery and the Monod-Wyman-Changeux Model After 50 Years

Changeux, J. (2012) · Annual Review of Biophysics · doi:10.1146/annurev-biophys-050511-102222 · Cited by 406

Shared structural mechanisms of general anaesthetics and benzodiazepines

Kim, J. J., Gharpure, A., Teng, J., Zhuang, Y., Howard, R. J., Zhu, S., Noviello, C., Walsh, R. M., Lindahl, E. R., & Hibbs, R. E. (2020) · Nature · doi:10.1038/s41586-020-2654-5 · Cited by 403

GABAA receptor: Positive and negative allosteric modulators

Olsen, R. W. (2018) · Neuropharmacology · doi:10.1016/j.neuropharm.2018.01.036 · Cited by 369

Allosteric Modulation as a Unifying Mechanism for Receptor Function and Regulation

Changeux, J., & Christopoulos, A. (2016) · Cell · doi:10.1016/j.cell.2016.08.015 · Cited by 353

Structural basis of Nav1.7 inhibition by an isoform-selective small-molecule antagonist

Ahuja, S., Mukund, S., Deng, L., Khakh, K., Chang, E., Ho, H., Shriver, S., Young, C., Lin, S., Johnson, J. P., et al. (2015) · Science · doi:10.1126/science.aac5464 · Cited by 319

Pathophysiological and neurochemical mechanisms of postoperative nausea and vomiting

Horn, C. C., Wallisch, W. J., Homanics, G. E., & Williams, J. P. (2013) · European Journal of Pharmacology · doi:10.1016/j.ejphar.2013.10.037 · Cited by 304

Multiscale Simulations of Biological Membranes: The Challenge To Understand Biological Phenomena in a Living Substance

Enkavi, G., Javanainen, M., Kulig, W., Róg, T., & Vattulainen, I. (2019) · Chemical Reviews · doi:10.1021/acs.chemrev.8b00538 · Cited by 293

Interfacial inhibitors: targeting macromolecular complexes

Pommier, Y. G., & Marchand, C. (2011) · Nature Reviews Drug Discovery · doi:10.1038/nrd3404 · Cited by 260

Positive allosteric modulators as an approach to nicotinic acetylcholine receptor-targeted therapeutics: Advantages and limitations

Williams, D. K., Wang, J., & Papke, R. L. (2011) · Biochemical Pharmacology · doi:10.1016/j.bcp.2011.05.001 · Cited by 252

The CatSper channel: a polymodal chemosensor in human sperm

Brenker, C., Goodwin, N., Weyand, I., Kashikar, N. D., Naruse, M., Krähling, A. M., Müller, A., Kaupp, U. B., & Strünker, T. (2012) · The EMBO Journal · doi:10.1038/emboj.2012.30 · Cited by 246

Towards a comprehensive understanding of anesthetic mechanisms of action: a decade of discovery

Hemmings, H. C., Riegelhaupt, P. M., Kelz, M. B., Solt, K., Eckenhoff, R. G., Orser, B. A., & Goldstein, P. A. (2019) · Trends in Pharmacological Sciences · doi:10.1016/j.tips.2019.05.001 · Cited by 244

International Union of Basic and Clinical Pharmacology. XC. Multisite Pharmacology: Recommendations for the Nomenclature of Receptor Allosterism and Allosteric Ligands

Christopoulos, A., Changeux, J., Catterall, W. A., Fabbro, D., Burris, T. P., Cidlowski, J. A., Olsen, R. W., Peters, J. A., Neubig, R. R., Pin, J., et al. (2014) · Pharmacological Reviews · doi:10.1124/pr.114.008862 · Cited by 246

Emerging Molecular Mechanisms of Signal Transduction in Pentameric Ligand-Gated Ion Channels

Nemecz, Á., Prevost, M. S., Menny, A., & Corringer, P. (2016) · Neuron · doi:10.1016/j.neuron.2016.03.032 · Cited by 250

Structure and Pharmacology of Pentameric Receptor Channels: From Bacteria to Brain

Corringer, P., Poitevin, F., Prevost, M. S., Sauguet, L., Delarue, M. H., & Changeux, J. (2012) · Structure · doi:10.1016/j.str.2012.05.003 · Cited by 251

The Nicotinic Acetylcholine Receptor: The Founding Father of the Pentameric Ligand-gated Ion Channel Superfamily

Changeux, J. (2012) · Journal of Biological Chemistry · doi:10.1074/jbc.r112.407668 · Cited by 235

A propofol binding site on mammalian GABAA receptors identified by photolabeling

Yip, G. M. S., Chen, Z.-W., Edge, C. J., Smith, E. H., Dickinson, R., Hohenester, E., Townsend, R. R., Fuchs, K., Sieghart, W., Evers, A. S., et al. (2013) · Nature Chemical Biology · doi:10.1038/nchembio.1340 · Cited by 226

Biological membranes: the importance of molecular detail

LEE, A. G. J. (2011) · Trends in Biochemical Sciences · doi:10.1016/j.tibs.2011.06.007 · Cited by 214

Crystal structures of a pentameric ligand-gated ion channel provide a mechanism for activation

Sauguet, L., Shahsavar, A., Poitevin, F., Huon, C., Menny, A., Nemecz, Á., Haouz, A., Changeux, J., Corringer, P., & Delarue, M. H. (2013) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1314997111 · Cited by 202

Allosteric Modulation of GABAA Receptors via Multiple Drug-Binding Sites

Sieghart, W. (2014) · Advances in pharmacology · doi:10.1016/bs.apha.2014.10.002 · Cited by 198

Inhibitory Glycine Receptors: An Update

Dutertre, S., Becker, C., & Betz, H. (2012) · Journal of Biological Chemistry · doi:10.1074/jbc.r112.408229 · Cited by 194

Crystal structures of a GABAA-receptor chimera reveal new endogenous neurosteroid-binding sites.

Laverty, D., Thomas, P., Field, M., Andersen, O. J., Gold, M. G., Biggin, P. C., Gielen, M., & Smart, T. G. (2017) · Nature Structural & Molecular Biology · doi:10.1038/nsmb.3477 · Cited by 179

50 years of allosteric interactions: the twists and turns of the models

Changeux, J. (2013) · Nature Reviews Molecular Cell Biology · doi:10.1038/nrm3695 · Cited by 177

Sub-anesthetic concentrations of (R, S)-ketamine metabolites inhibit acetylcholine-evoked currents in α7 nicotinic acetylcholine receptors

Moaddel, R., Abdrakhmanova, G., Kozak, J., Jozwiak, K., Toll, L., Jimenez, L., Rosenberg, A., Tran, T., Xiao, Y., Zarate, C. A., et al. (2013) · European Journal of Pharmacology · doi:10.1016/j.ejphar.2012.11.023 · Cited by 176

Understanding the Bases of Function and Modulation of α7 Nicotinic Receptors: Implications for Drug Discovery

Corradi, J., & Bouzat, C. (2016) · Molecular Pharmacology · doi:10.1124/mol.116.104240 · Cited by 163

Propofol: Milk of Amnesia

Walsh, C. T. (2018) · Cell · doi:10.1016/j.cell.2018.08.031 · Cited by 163

Ligand-Gated Ion Channels: New Insights into Neurological Disorders and Ligand Recognition

Lemoine, D., Jiang, R., Taly, A., Chataigneau, T., Specht, A., & Grütter, T. (2012) · Chemical Reviews · doi:10.1021/cr3000829 · Cited by 176

Lipid-Dependent Regulation of Ion Channels and G Protein–Coupled Receptors: Insights from Structures and Simulations

Duncan, A. L., Song, W., & Sansom, M. S. P. (2020) · Annual Review of Pharmacology and Toxicology · doi:10.1146/annurev-pharmtox-010919-023411 · Cited by 158

Molecular Simulation Approaches to Membrane Proteins

Stansfeld, P. J., & Sansom, M. S. P. (2011) · Structure · doi:10.1016/j.str.2011.10.002 · Cited by 157

How drugs get into cells: tested and testable predictions to help discriminate between transporter-mediated uptake and lipoidal bilayer diffusion

Kell, D. B., & Oliver, S. G. (2014) · Frontiers in Pharmacology · doi:10.3389/fphar.2014.00231 · Cited by 158

The Biology of General Anesthesia from Paramecium to Primate

Kelz, M. B., & Mashour, G. A. (2019) · Current Biology · doi:10.1016/j.cub.2019.09.071 · Cited by 151

Evolution of Synapse Complexity and Diversity

Emes, R. D., & Grant, S. G. N. (2012) · Annual Review of Neuroscience · doi:10.1146/annurev-neuro-062111-150433 · Cited by 161

A gating mechanism of pentameric ligand-gated ion channels

Calimet, N., Simoes, M., Changeux, J.-P., Karplus, M., Taly, A., & Cecchini, M. (2013) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1313785110 · Cited by 150

Structural basis for ion permeation mechanism in pentameric ligand‐gated ion channels

Sauguet, L., Poitevin, F., Murail, S., Renterghem, C. V., Moraga‐Cid, G., Malherbe, L., Thompson, A., Koehl, P., Corringer, P., Baaden, M., et al. (2013) · The EMBO Journal · doi:10.1038/emboj.2013.17 · Cited by 152

Atomistic Simulations of Membrane Ion Channel Conduction, Gating, and Modulation

Flood, E., Boiteux, C., Lev, B. B., Vorobyov, I. V., & Allen, T. W. (2019) · Chemical Reviews · doi:10.1021/acs.chemrev.8b00630 · Cited by 146

The promiscuous binding of pharmaceutical drugs and their transporter-mediated uptake into cells: what we (need to) know and how we can do so

Kell, D. B., Dobson, P. D., Bilsland, E., & Oliver, S. G. (2012) · Drug Discovery Today · doi:10.1016/j.drudis.2012.11.008 · Cited by 144

A locally closed conformation of a bacterial pentameric proton-gated ion channel

Prevost, M. S., Sauguet, L., Nury, H., Renterghem, C. V., Huon, C., Poitevin, F., Baaden, M., Delarue, M. H., & Corringer, P. (2012) · Nature Structural & Molecular Biology · doi:10.1038/nsmb.2307 · Cited by 140

The impact of human hyperekplexia mutations on glycine receptor structure and function

Bode, A., & Lynch, J. W. (2014) · Molecular Brain · doi:10.1186/1756-6606-7-2 · Cited by 136

Meta-diamide insecticides acting on distinct sites of RDL GABA receptor from those for conventional noncompetitive antagonists

Nakao, T., Banba, S., Nomura, M., & Hirase, K. (2013) · Insect Biochemistry and Molecular Biology · doi:10.1016/j.ibmb.2013.02.002 · Cited by 135

Specificity of Intersubunit General Anesthetic-binding Sites in the Transmembrane Domain of the Human α1β3γ2 γ-Aminobutyric Acid Type A (GABAA) Receptor*

Chiara, D. C., Jayakar, S. S., Zhou, X., Zhang, X., Savechenkov, P. Y., Bruzik, K. S., Miller, K. W., & Cohen, J. B. (2013) · Journal of Biological Chemistry · doi:10.1074/jbc.m113.479725 · Cited by 133

Structural basis for potentiation by alcohols and anaesthetics in a ligand-gated ion channel

Sauguet, L., Howard, R. J., Malherbe, L., Lee, U. S., Corringer, P., Harris, R. A., & Delarue, M. H. (2013) · Nature Communications · doi:10.1038/ncomms2682 · Cited by 132

The nicotinic acetylcholine receptor and its prokaryotic homologues: Structure, conformational transitions & allosteric modulation

Cecchini, M., & Changeux, J. (2014) · Neuropharmacology · doi:10.1016/j.neuropharm.2014.12.006 · Cited by 128

Gating of Pentameric Ligand-Gated Ion Channels: Structural Insights and Ambiguities

daCosta, C. J. B., & Baenziger, J. E. (2013) · Structure · doi:10.1016/j.str.2013.06.019 · Cited by 120

The Concise Guide to PHARMACOLOGY 2013/14: Ligand‐Gated Ion Channels

Alexander, S. P. H., Benson, H. E., Faccenda, E., Pawson, A. J., Sharman, J. L., Spedding, M., Peters, J. A., Harmar, A. J., & Collaborators, C. (2013) · British Journal of Pharmacology · doi:10.1111/bph.12446 · Cited by 120

Molecular dynamics simulations of the interactions of medicinal plant extracts and drugs with lipid bilayer membranes

Kopeć, W., Telenius, J. M., & Khandelia, H. (2013) · FEBS Journal · doi:10.1111/febs.12286 · Cited by 118

Ligand binding at the protein–lipid interface: strategic considerations for drug design

Payandeh, J., & Volgraf, M. (2021) · Nature Reviews Drug Discovery · doi:10.1038/s41573-021-00240-2 · Cited by 121

Multiple Propofol-binding Sites in a γ-Aminobutyric Acid Type A Receptor (GABAAR) Identified Using a Photoreactive Propofol Analog

Jayakar, S. S., Zhou, X., Chiara, D. C., Dostalova, Z., Savechenkov, P. Y., Bruzik, K. S., Dailey, W. P., Miller, K. W., Eckenhoff, R. G., & Cohen, J. B. (2014) · Journal of Biological Chemistry · doi:10.1074/jbc.m114.581728 · Cited by 118

γ-Aminobutyrate- and Glutamate-gated Chloride Channels as Targets of Insecticides

Ozoe, Y. (2013) · Advances in insect physiology · doi:10.1016/b978-0-12-394389-7.00004-1 · Cited by 115

Liquid General Anesthetics Lower Critical Temperatures in Plasma Membrane Vesicles

Gray, E. J., Karslake, J. D., Machta, B. B., & Veatch, S. L. (2013) · Biophysical Journal · doi:10.1016/j.bpj.2013.11.005 · Cited by 111

Molecular blueprint of allosteric binding sites in a homologue of the agonist-binding domain of the α7 nicotinic acetylcholine receptor

Spurný, R., Debaveye, S., Farinha, A., Veys, K., Vos, A. M., Gossas, T., Atack, J. R., Bertrand, S., Bertrand, D., Danielson, U. H., et al. (2015) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1418289112 · Cited by 113

Mapping General Anesthetic Binding Site(s) in Human α1β3 γ-Aminobutyric Acid Type A Receptors with [3H]TDBzl-Etomidate, a Photoreactive Etomidate Analogue

Chiara, D. C., Dostalova, Z., Jayakar, S. S., Zhou, X., Miller, K. W., & Cohen, J. B. (2012) · Biochemistry · doi:10.1021/bi201772m · Cited by 109

Structural basis for alcohol modulation of a pentameric ligand-gated ion channel

Howard, R. J., Murail, S., Ondricek, K. E., Corringer, P., Lindahl, E. R., Trudell, J. R., & Harris, R. A. (2011) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1104480108 · Cited by 106

Allosteric modulation of glycine receptors

Yévenes, G. E., & Zeilhofer, H. U. (2011) · British Journal of Pharmacology · doi:10.1111/j.1476-5381.2011.01471.x · Cited by 111

Allosteric modulation of nicotinic acetylcholine receptors.

Chatzidaki, A., & Millar, N. (2015) · Biochemical Pharmacology · doi:10.1016/j.bcp.2015.07.028 · Cited by 164

Anesthetic sites and allosteric mechanisms of action on Cys-loop ligand-gated ion channels

Forman, S. A., & Miller, K. W. (2011) · Canadian Journal of Anesthesia/Journal canadien d anesthésie · doi:10.1007/s12630-010-9419-9 · Cited by 104

Multiple functional neurosteroid binding sites on GABAA receptors

Chen, Z.-W., Bracamontes, J. R., Budelier, M. M., Germann, A. L., Shin, D. J., Krishnan, K., Qian, M., Manion, B. D., Cheng, W. W. L., Reichert, D. E. C., et al. (2019) · PLoS Biology · doi:10.1371/journal.pbio.3000157 · Cited by 102

The Primitive Thylakoid-Less Cyanobacterium Gloeobacter Is a Common Rock-Dwelling Organism

Mareš, J., Hrouzek, P., Kaňa, R., Ventura, S., Strunecký, O., & Komárek, J. (2013) · PLoS ONE · doi:10.1371/journal.pone.0066323 · Cited by 98

The nicotinic acetylcholine receptor: a typical ‘allosteric machine’

Changeux, J. (2018) · Philosophical Transactions of the Royal Society B Biological Sciences · doi:10.1098/rstb.2017.0174 · Cited by 106

GABAA receptor modulation by terpenoids from Sideritis extracts

Kessler, A., Nadeem, H. Ş., Lummis, S. C. R., Weigel, I., Pischetsrieder, M., Buettner, A., & Villmann, C. (2013) · Molecular Nutrition & Food Research · doi:10.1002/mnfr.201300420 · Cited by 99

A novel GABAAreceptor pharmacology: drugs interacting with the α+β‐interface

Sieghart, W., Ramerstorfer, J., Sarto‐Jackson, I., Varagić, Z., & Ernst, M. C. (2011) · British Journal of Pharmacology · doi:10.1111/j.1476-5381.2011.01779.x · Cited by 102

Mechanism of action of the insecticides, lindane and fipronil, on glycine receptor chloride channels

Islam, R., & Lynch, J. W. (2011) · British Journal of Pharmacology · doi:10.1111/j.1476-5381.2011.01722.x · Cited by 99

Multisite Binding of a General Anesthetic to the Prokaryotic Pentameric Erwinia chrysanthemi Ligand-gated Ion Channel (ELIC)

Spurný, R., Billen, B., Howard, R. J., Brams, M., Debaveye, S., Price, K. L., Weston, D. A., Strelkov, S. V., Tytgat, J., Bertrand, S., et al. (2013) · Journal of Biological Chemistry · doi:10.1074/jbc.m112.424507 · Cited by 92

Structural Studies of GABAA Receptor Binding Sites: Which Experimental Structure Tells us What?

Puthenkalam, R., Hieckel, M., Simeone, X., Suwattanasophon, C., Feldbauer, R., Ecker, G. F., & Ernst, M. C. (2016) · Frontiers in Molecular Neuroscience · doi:10.3389/fnmol.2016.00044 · Cited by 93

Rational design of allosteric modulators: Challenges and successes

Chatzigoulas, A., & Cournia, Z. (2021) · Wiley Interdisciplinary Reviews Computational Molecular Science · doi:10.1002/wcms.1529 · Cited by 90

Inhibition of K-RAS4B by a Unique Mechanism of Action: Stabilizing Membrane-Dependent Occlusion of the Effector-Binding Site

Fang, Z., Marshall, C. B., Nishikawa, T., Gossert, A. D., Jansen, J. M., Jahnke, W., & Ikura, M. (2018) · Cell Chemical Biology · doi:10.1016/j.chembiol.2018.07.009 · Cited by 86

The concept of allosteric modulation: an overview

Changeux, J. (2012) · Drug Discovery Today Technologies · doi:10.1016/j.ddtec.2012.07.007 · Cited by 86

Mutations that stabilize the open state of the Erwinia chrisanthemi ligand-gated ion channel fail to change the conformation of the pore domain in crystals

González-Gutiérrez, G., Lukk, T., Agarwal, V., Papke, D. J., Nair, S. K., & Grosman, C. F. (2012) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1119268109 · Cited by 85

A Predicted Binding Site for Cholesterol on the GABAA Receptor

Hénin, J., Salari, R., Murlidaran, S., & Brannigan, G. H. (2014) · Biophysical Journal · doi:10.1016/j.bpj.2014.03.024 · Cited by 87

Structure and pharmacologic modulation of inhibitory glycine receptors

Burgos, C. F., Yévenes, G. E., & Aguayo, L. G. (2016) · Molecular Pharmacology · doi:10.1124/mol.116.105726 · Cited by 83

Functional prokaryotic–eukaryotic chimera from the pentameric ligand-gated ion channel family

Duret, G., Renterghem, C. V., Weng, Y., Prevost, M. S., Moraga‐Cid, G., Huon, C., Sonner, J. M., & Corringer, P. (2011) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1104494108 · Cited by 85

Structure of the Pentameric Ligand-Gated Ion Channel GLIC Bound with Anesthetic Ketamine

Pan, J., Chen, Q., Willenbring, D., Mowrey, D. D., Kong, X., Cohen, A. E., Divito, C. B., Xu, Y., & Tang, P. S. (2012) · Structure · doi:10.1016/j.str.2012.08.009 · Cited by 81

Molecular Mechanisms of Drug Action: An Emerging View

Sonner, J. M., & Cantor, R. S. (2013) · Annual Review of Biophysics · doi:10.1146/annurev-biophys-083012-130341 · Cited by 79

String method solution of the gating pathways for a pentameric ligand-gated ion channel

Lev, B. B., Murail, S., Poitevin, F., Cromer, B. A., Baaden, M., Delarue, M. H., & Allen, T. W. (2017) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.1617567114 · Cited by 78

G protein coupled receptor interactions with cholesterol deep in the membrane

Genheden, S., Essex, J. W., & LEE, A. G. J. (2016) · Biochimica et Biophysica Acta (BBA) - Biomembranes · doi:10.1016/j.bbamem.2016.12.001 · Cited by 74

Identification of Propofol Binding Sites in a Nicotinic Acetylcholine Receptor with a Photoreactive Propofol Analog*

Jayakar, S. S., Dailey, W. P., Eckenhoff, R. G., & Cohen, J. B. (2013) · Journal of Biological Chemistry · doi:10.1074/jbc.m112.435909 · Cited by 76

Mapping General Anesthetic Sites in Heteromeric γ-Aminobutyric Acid Type A Receptors Reveals a Potential For Targeting Receptor Subtypes

Forman, S. A., & Miller, K. W. (2016) · Anesthesia & Analgesia · doi:10.1213/ane.0000000000001368 · Cited by 72

Theory and Simulation of Ion Conduction in the Pentameric GLIC Channel

Zhu, F., & Hummer, G. (2012) · Journal of Chemical Theory and Computation · doi:10.1021/ct2009279 · Cited by 71

Functional anatomy of an allosteric protein

Purohit, P. G., Gupta, S., Jadey, S. V., & Auerbach, A. L. (2013) · Nature Communications · doi:10.1038/ncomms3984 · Cited by 71

Single-Channel and Structural Foundations of Neuronal α7 Acetylcholine Receptor Potentiation

daCosta, C. J. B., Free, C. R., Corradi, J., Bouzat, C., & Sine, S. M. (2011) · Journal of Neuroscience · doi:10.1523/jneurosci.2652-11.2011 · Cited by 73

Shaker-related potassium channels in the central medial nucleus of the thalamus are important molecular targets for arousal suppression by volatile general anesthetics

Lioudyno, M. I., Birch, A. M., Tanaka, B. S., Sokolov, Y., Goldin, A. L., Chandy, K. G., Hall, J. E., & Alkire, M. T. (2013) · The Journal of Neuroscience · doi:10.1523/jneurosci.0344-13.2013 · Cited by 68

The Glycine Receptor—A Functionally Important Primary Brain Target of Ethanol

Söderpalm, B., Lidö, H. H., & Ericson, M. (2017) · Alcoholism Clinical and Experimental Research · doi:10.1111/acer.13483 · Cited by 68

GABA allosteric modulators: An overview of recent developments in non-benzodiazepine modulators

Solomon, V. R., Tallapragada, V. J., Chebib, M., Johnston, G. A. R., & Hanrahan, J. R. (2019) · European Journal of Medicinal Chemistry · doi:10.1016/j.ejmech.2019.03.043 · Cited by 69

Crystal structure and dynamics of a lipid-induced potential desensitized-state of a pentameric ligand-gated channel

Basak, S., Schmandt, N., Gicheru, Y. W., & Chakrapani, S. (2017) · eLife · doi:10.7554/elife.23886 · Cited by 72

Structural mechanisms of activation and desensitization in neurotransmitter-gated ion channels

Plested, A. J. R. (2016) · Nature Structural & Molecular Biology · doi:10.1038/nsmb.3214 · Cited by 67

Binding of Serotonin to Lipid Membranes

Peters, G. H. J., Wang, C., Cruys‐Bagger, N., Velardez, G. F., Madsen, J. J., & Westh, P. (2013) · Journal of the American Chemical Society · doi:10.1021/ja306681d · Cited by 65

Nicotinic acetylcholine receptor–lipid interactions: Mechanistic insight and biological function

Baenziger, J. E., Hénault, C. M., Therien, J. P. D., & Sun, J. (2015) · Biochimica et Biophysica Acta (BBA) - Biomembranes · doi:10.1016/j.bbamem.2015.03.010 · Cited by 65

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