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Crystal structure

Aureochrome 1 Illuminated: Structural Changes of a Transcription Factor Probed by Molecular Spectroscopy

Silke Kerruth, Kenichi Ataka, [ ... ], Joachim Heberle

Design, Synthesis and Pharmacological Evaluation of Novel Vanadium-Containing Complexes as Antidiabetic Agents

Elena V. Fedorova, Anna V. Buryakina, [ ... ], Vladimir V. Poroikov

The Structure of RdDddP from Roseobacter denitrificans Reveals That DMSP Lyases in the DddP-Family Are Metalloenzymes

Jan-Hendrik Hehemann, Adrienne Law, Lars Redecke, Alisdair B. Boraston

A Unique Mono- and Diacylglycerol Lipase from Penicillium cyclopium: Heterologous Expression, Biochemical Characterization and Molecular Basis for Its Substrate Selectivity

Zhong-Biao Tan, Jian-Fang Li, [ ... ], Jun-Qing Wang

In Silico Structural Homology Modelling and Docking for Assessment of Pandemic Potential of a Novel H7N9 Influenza Virus and Its Ability to Be Neutralized by Existing Anti-Hemagglutinin Antibodies

Harinda Rajapaksha, Nikolai Petrovsky

Principles of Calcite Dissolution in Human and Artificial Otoconia

Leif Erik Walther, Alexander Blödow, Jana Buder, Rüdiger Kniep

Structure-Based Rational Design to Enhance the Solubility and Thermostability of a Bacterial Laccase Lac15

Zemin Fang, Peng Zhou, [ ... ], Yazhong Xiao

Computational Investigation of Locked Nucleic Acid (LNA) Nucleotides in the Active Sites of DNA Polymerases by Molecular Docking Simulations

Vasanthanathan Poongavanam, Praveen K. Madala, Torben Højland, Rakesh N. Veedu

Dynamically-Driven Enhancement of the Catalytic Machinery of the SARS 3C-Like Protease by the S284-T285-I286/A Mutations on the Extra Domain

Liangzhong Lim, Jiahai Shi, Yuguang Mu, Jianxing Song

Dynamic and Multi-Pharmacophore Modeling for Designing Polo-Box Domain Inhibitors

Sugunadevi Sakkiah, Silvia Senese, [ ... ], Jorge Z. Torres

Crosslinking Constraints and Computational Models as Complementary Tools in Modeling the Extracellular Domain of the Glycine Receptor

Zhenyu Liu, Agnieszka Szarecka, [ ... ], Michael Cascio

Comparing Binding Modes of Analogous Fragments Using NMR in Fragment-Based Drug Design: Application to PRDX5

Clémentine Aguirre, Tim ten Brink, [ ... ], Isabelle Krimm

The Structure of the TFIIH p34 Subunit Reveals a Von Willebrand Factor A Like Fold

Dominik R. Schmitt, Jochen Kuper, Agnes Elias, Caroline Kisker

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