Comparative study of binding pocket structure and dynamics in cardiac and skeletal myosin

Myosin with hypertrophic cardiac mutation R712L has a decreased working stroke which is rescued by omecamtiv mecarbil

(2021) Aaron Snoberger et al.   eLife

Filamentous tangles with nemaline rods in MYH2 myopathy: a novel phenotype

(2021) Nicolas N. Madigan et al.   Acta Neuropathologica Communications

Discovery of Aficamten (CK-274), a Next-Generation Cardiac Myosin Inhibitor for the Treatment of Hypertrophic Cardiomyopathy

(2021) Chihyuan Chuang et al.   JOURNAL OF MEDICINAL CHEMISTRY

Effects of danicamtiv, a novel cardiac myosin activator, in heart failure with reduced ejection fraction: experimental data and clinical results from a phase 2a trial

(2020) Adriaan A. Voors et al.   EUROPEAN JOURNAL OF HEART FAILURE

Single Residue Variation in Skeletal Muscle Myosin Enables Direct and Selective Drug Targeting for Spasticity and Muscle Stiffness

(2020) Máté Gyimesi et al.   CELL

Heart Failure Drug Modifies the Intrinsic Dynamics of the Pre-Power Stroke State of Cardiac Myosin

(2020) Shaima Hashem et al.   Journal of Chemical Information and Modeling

Cardiac Myosin Activation with Omecamtiv Mecarbil in Systolic Heart Failure

(2020) John R. Teerlink et al.   NEW ENGLAND JOURNAL OF MEDICINE

Dilated cardiomyopathy mutation in the converter domain of human cardiac myosin alters motor activity and response to omecamtiv mecarbil

(2019) Wanjian Tang et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

Congenital myopathies: disorders of excitation–contraction coupling and muscle contraction

(2018) Heinz Jungbluth et al.   Nature Reviews Neurology

Positive cardiac inotrope omecamtiv mecarbil activates muscle despite suppressing the myosin working stroke

(2018) Michael S. Woody et al.   Nature Communications

Hypertrophic cardiomyopathy disease results from disparate impairments of cardiac myosin function and auto-inhibition

(2018) Julien Robert-Paganin et al.   Nature Communications

Sarcopenia: Aging-Related Loss of Muscle Mass and Function

(2018) Lars Larsson et al.   PHYSIOLOGICAL REVIEWS

Omecamtiv Mecarbil Enhances the Duty Ratio of Human β-Cardiac Myosin Resulting in Increased Calcium Sensitivity and Slowed Force Development in Cardiac Muscle

(2017) Anja M. Swenson et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

Omecamtiv mercabil and blebbistatin modulate cardiac contractility by perturbing the regulatory state of the myosin filament

(2017) Thomas Kampourakis et al.   JOURNAL OF PHYSIOLOGY-LONDON

Heart failure drug changes the mechanoenzymology of the cardiac myosin powerstroke

(2017) John A. Rohde et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

MolProbity: More and better reference data for improved all-atom structure validation

(2017) Christopher J. Williams et al.   PROTEIN SCIENCE

Mechanistic and structural basis for activation of cardiac myosin force production by omecamtiv mecarbil

(2017) Vicente J. Planelles-Herrero et al.   Nature Communications

Allosteric modulation of cardiac myosin dynamics by omecamtiv mecarbil

(2017) Shaima Hashem et al.   PLoS Computational Biology

Modulating myosin restores muscle function in a mouse model of nemaline myopathy

(2016) Johan Lindqvist et al.   ANNALS OF NEUROLOGY

Novel myosin-based therapies for congenital cardiac and skeletal myopathies

(2016) Julien Ochala et al.   JOURNAL OF MEDICAL GENETICS

A small-molecule inhibitor of sarcomere contractility suppresses hypertrophic cardiomyopathy in mice

(2016) E. M. Green et al.   SCIENCE

Omecamtiv Mecarbil Modulates the Kinetic and Motile Properties of Porcine β-Cardiac Myosin

(2015) Yingying Liu et al.   BIOCHEMISTRY

PLIP: fully automated protein–ligand interaction profiler

(2015) Sebastian Salentin et al.   NUCLEIC ACIDS RESEARCH

Structural basis for drug-induced allosteric changes to human β-cardiac myosin motor activity

(2015) Donald A. Winkelmann et al.   Nature Communications

Integrating protein structural dynamics and evolutionary analysis with Bio3D

(2014) Lars Skjærven et al.   BMC BIOINFORMATICS

Systematic Validation of Protein Force Fields against Experimental Data

(2012) Kresten Lindorff-Larsen et al.   PLoS One

MDpocket: open-source cavity detection and characterization on molecular dynamics trajectories

(2011) Peter Schmidtke et al.   BIOINFORMATICS

Rapid Shape-Based Ligand Alignment and Virtual Screening Method Based on Atom/Feature-Pair Similarities and Volume Overlap Scoring

(2011) G. Madhavi Sastry et al.   Journal of Chemical Information and Modeling

Cardiac Myosin Activation: A Potential Therapeutic Approach for Systolic Heart Failure

(2011) F. I. Malik et al.   SCIENCE

fpocket: online tools for protein ensemble pocket detection and tracking

(2010) P. Schmidtke et al.   NUCLEIC ACIDS RESEARCH

MolProbity: all-atom structure validation for macromolecular crystallography

(2009) Vincent B. Chen et al.   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

(2009) Garrett M. Morris et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

QMEAN: A comprehensive scoring function for model quality assessment

(2007) Pascal Benkert et al.   PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS