Dissociation of hERG channel inhibitors

Anna Weinzinger
University of Vienna (Universität Wien)
Department für Pharmakologie und Toxikologie, Department für Pharmakologie und Toxikologie

VSC project / type: 70222 / funded

VSC-1 / status: 2011-07-15 - 2015-03-28 / finished

Publications:

  • Linder Tobias, Saxena Priyanka, Timin Eugen, Hering Steffen, Stary-Weinzinger Anna
    Structural Insights into Trapping and Dissociation of Small Molecules in K+ Channels
    JOURNAL OF CHEMICAL INFORMATION AND MODELING 54, 3218 (2014)

  • Linder Tobias, de Groot Bert L., Stary-Weinzinger Anna
    Probing the Energy Landscape of Activation Gating of the Bacterial Potassium Channel KcsA
    PLOS COMPUTATIONAL BIOLOGY 9, e1003058 (2013)

  • Garg Vivek, Stary-Weinzinger Anna, Sanguinetti Michael C.
    ICA-105574 Interacts with a Common Binding Site to Elicit Opposite Effects on Inactivation Gating of EAG and ERG Potassium Channels
    MOLECULAR PHARMACOLOGY 83, 805 (2013)

  • Linder Tobias, Stary-Weinzinger Anna
    Activation Gating of KcsA: New Insights into Cooperativity and Energy Landscape from Essential Dynamics Simulations
    BIOPHYSICAL JOURNAL 104, 128A (2013)

  • Linder Tobias, Stary-Weinzinger Anna
    Pore Gating of K plus Channels Studied by Essential Dynamics Simulations using the Simplified Bacterial K plus Channel KcsA
    BIOPHYSICAL JOURNAL 102, 397A (2012)

  • Knape Kirsten, Linder Tobias, Wolschann Peter, Beyer Anton, Stary-Weinzinger Anna
    In silico Analysis of Conformational Changes Induced by Mutation of Aromatic Binding Residues: Consequences for Drug Binding in the hERG K+ Channel
    PLOS ONE 6, e28778 (2011)

  • Garg Vivek, Stary-Weinzinger Anna, Sachse Frank, Sanguinetti Michael C.
    Molecular Determinants for Activation of Human Ether-a-go-go-related Gene 1 Potassium Channels by 3-Nitro-N-(4-phenoxyphenyl) Benzamide
    MOLECULAR PHARMACOLOGY 80, 630 (2011)

  • Knape Kirsten, Linder Tobias, Stary-Weinzinger Anna
    MD simulations reveal mutation induced reorientation of binding residues in the hERG K plus channel
    EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS 40, 173 (2011)



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