Conformational Transitions upon Ligand Binding: Holo-Structure Prediction from Apo Conformations

Open Access

Peer-reviewed

Research Article

Daniel Seeliger,

Affiliation Computational Biomolecular Dynamics Group, Max-Planck-Institute for Biophysical Chemistry, Göttingen, Germany
⨯
Bert L. de Groot

* E-mail: bgroot@gwdg.de

Affiliation Computational Biomolecular Dynamics Group, Max-Planck-Institute for Biophysical Chemistry, Göttingen, Germany
⨯

About the Authors

Daniel Seeliger

Affiliation Computational Biomolecular Dynamics Group, Max-Planck-Institute for Biophysical Chemistry, Göttingen, Germany

Bert L. de Groot

* E-mail: bgroot@gwdg.de

Affiliation Computational Biomolecular Dynamics Group, Max-Planck-Institute for Biophysical Chemistry, Göttingen, Germany

The authors have declared that no competing interests exist.

Conceived and designed the experiments: DS BLdG. Performed the experiments: DS. Analyzed the data: DS. Wrote the paper: DS BLdG.

Protein structure prediction
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Protein structure
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Molecular dynamics
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Protein structure determination
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Crystal structure
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Receptor physiology
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DNA-binding proteins
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Drug design
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