| Home > Publications Database > Dataset: Enzyme-substrate hybrid β-sheet controls geometry and water access to the γ-secretase active site, v1 |
| Dataset | DZNE-2025-00203 |
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2023
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Please use a persistent id in citations: doi:10.5281/ZENODO.7953842 doi:10.5281/zenodo.7953842
Abstract: Raw data, initial PDB files, and Python codes used to generate the figures in the work ' Enzyme-substrate hybrid β-sheet controls geometry and water access to the γ-secretase active site ' in Communication Biology. To generate the figures, unzip data.zip and launch Jupyter notebook/lab in the directory './data/analysis' and run all codes in notebooks 'Plot_restraint-free.ipynb' and 'Plot_PMF.ipynb' . Python dependency: python 3.x numpy matplotlib pandas seaborn scipy
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Journal Article
Enzyme-substrate hybrid β-sheet controls geometry and water access to the γ-secretase active site.
Communications biology 6(1), 670 (2023) [10.1038/s42003-023-05039-y]
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