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Symmetry-adapted Markov state models of closing, opening, and desensitizing in α 7 nicotinic acetylcholine receptors

Nature communications, 2024-10, Vol.15 (1), p.9022-14, Article 9022

2024

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Structural and dynamic mechanisms of GABAA receptor modulators with opposing activities

Nature communications, 2022-08, Vol.13 (1), p.4582-4582, Article 4582

2022

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An α-π transition in S6 shapes the conformational cycle of the bacterial sodium channel NavAb

The Journal of general physiology, 2023-02, Vol.155 (2), p.1

2023

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Climatic controls on the global distribution, abundance, and species richness of mangrove forests

Ecological monographs, 2017-05, Vol.87 (2), p.341-359

2017

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Divergent mechanisms of steroid inhibition in the human ρ1 GABAA receptor

Nature communications, 2024-09, Vol.15 (1), p.7795-13, Article 7795

2024

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Structural insights into opposing actions of neurosteroids on GABAA receptors

Nature communications, 2023-08, Vol.14 (1), p.5091-13, Article 5091

2023

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tRNA shape is an identity element for an archaeal pyrrolysyl-tRNA synthetase from the human gut

Nucleic acids research, 2024-01, Vol.52 (2), p.513-524

2024

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Allosteric inhibition of CFTR gating by CFTRinh-172 binding in the pore

Nature communications, 2024-08, Vol.15 (1), p.6668-13, Article 6668

2024

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Elephants in the Dark: Insights and Incongruities in Pentameric Ligand-gated Ion Channel Models

Journal of molecular biology, 2021-08, Vol.433 (17), p.167128-167128, Article 167128

Howard, Rebecca J.

2021

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MDverse, shedding light on the dark matter of molecular dynamics simulations

eLife, 2024-08, Vol.12

2024

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

Proceedings of the National Academy of Sciences - PNAS, 2011-07, Vol.108 (29), p.12149-12154

2011

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Structural Basis for a Bimodal Allosteric Mechanism of General Anesthetic Modulation in Pentameric Ligand-Gated Ion Channels

Cell reports (Cambridge), 2018-04, Vol.23 (4), p.993-1004

2018

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Allosteric Cholesterol Site in Glycine Receptors Characterized through Molecular Simulations

The journal of physical chemistry. B, 2024-05, Vol.128 (20), p.4996-5007

2024

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Permeating disciplines: Overcoming barriers between molecular simulations and classical structure-function approaches in biological ion transport

Biochimica et biophysica acta. Biomembranes, 2018-04, Vol.1860 (4), p.927-942

2018

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Molecular Dynamics Simulations of Ion Channels

Trends in biochemical sciences (Amsterdam. Regular ed.), 2021-07, Vol.46 (7), p.621-622

2021

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Hydrologic restoration in a dynamic subtropical mangrove‐to‐marsh ecotone

Restoration ecology, 2017-05, Vol.25 (3), p.471-482

2017

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Shared structural mechanisms of general anaesthetics and benzodiazepines

Nature (London), 2020-09, Vol.585 (7824), p.303-308

2020

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Molecular mechanism for the dual alcohol modulation of Cys-loop receptors

PLoS computational biology, 2012-10, Vol.8 (10), p.e1002710-e1002710

2012

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Divergent mechanisms of steroid inhibition in the human ρ1 GABA A receptor

Nature communications, 2024-09, Vol.15 (1), p.7795

2024

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The Structure of the APPBP1-UBA3-NEDD8-ATP Complex Reveals the Basis for Selective Ubiquitin-like Protein Activation by an E1

Molecular cell, 2003-12, Vol.12 (6), p.1427-1437

2003

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Inhibition versus Potentiation of Ligand-Gated Ion Channels Can Be Altered by a Single Mutation that Moves Ligands between Intra- and Intersubunit Sites

Structure (London), 2013-08, Vol.21 (8), p.1307-1316

2013

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Structure and dynamics of differential ligand binding in the human ρ-type GABAA receptor

Neuron (Cambridge, Mass.), 2023-11, Vol.111 (21), p.3450-3464.e5

2023

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Structural basis for allosteric transitions of a multidomain pentameric ligand-gated ion channel

Proceedings of the National Academy of Sciences - PNAS, 2020-06, Vol.117 (24), p.13437-13446

2020

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Agonist Selectivity and Ion Permeation in the α3β4 Ganglionic Nicotinic Receptor

Neuron (Cambridge, Mass.), 2019-11, Vol.104 (3), p.501-511.e6

2019

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Discovery of lipid binding sites in a ligand-gated ion channel by integrating simulations and cryo-EM

eLife, 2024-01, Vol.12, p.2023

2024

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Symmetry-adapted Markov state models of closing, opening, and desensitizing in α 7 nicotinic acetylcholine receptors

Structural and dynamic mechanisms of GABAA receptor modulators with opposing activities

An α-π transition in S6 shapes the conformational cycle of the bacterial sodium channel NavAb

Climatic controls on the global distribution, abundance, and species richness of mangrove forests

Divergent mechanisms of steroid inhibition in the human ρ1 GABAA receptor

Structural insights into opposing actions of neurosteroids on GABAA receptors

tRNA shape is an identity element for an archaeal pyrrolysyl-tRNA synthetase from the human gut

Allosteric inhibition of CFTR gating by CFTRinh-172 binding in the pore

Elephants in the Dark: Insights and Incongruities in Pentameric Ligand-gated Ion Channel Models

MDverse, shedding light on the dark matter of molecular dynamics simulations

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

Structural Basis for a Bimodal Allosteric Mechanism of General Anesthetic Modulation in Pentameric Ligand-Gated Ion Channels

Allosteric Cholesterol Site in Glycine Receptors Characterized through Molecular Simulations

Permeating disciplines: Overcoming barriers between molecular simulations and classical structure-function approaches in biological ion transport

Molecular Dynamics Simulations of Ion Channels

Hydrologic restoration in a dynamic subtropical mangrove‐to‐marsh ecotone

Shared structural mechanisms of general anaesthetics and benzodiazepines

Molecular mechanism for the dual alcohol modulation of Cys-loop receptors

Divergent mechanisms of steroid inhibition in the human ρ1 GABA A receptor

The Structure of the APPBP1-UBA3-NEDD8-ATP Complex Reveals the Basis for Selective Ubiquitin-like Protein Activation by an E1

Inhibition versus Potentiation of Ligand-Gated Ion Channels Can Be Altered by a Single Mutation that Moves Ligands between Intra- and Intersubunit Sites

Structure and dynamics of differential ligand binding in the human ρ-type GABAA receptor

Structural basis for allosteric transitions of a multidomain pentameric ligand-gated ion channel

Agonist Selectivity and Ion Permeation in the α3β4 Ganglionic Nicotinic Receptor

Discovery of lipid binding sites in a ligand-gated ion channel by integrating simulations and cryo-EM

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