Published April 30, 2023
| Version v2
Dataset
Open
Computational redesign of cytochrome P450 CYP102A1 for highly stereoselective omeprazole hydroxylation by UniDesign
Description
To make it consistent with our manuscript, in this version of Zenodo dataset, all "conformers" have been changed to "poses" in the file names and the contents of the Perl scripts (in Scripts.zip).
Files
DesignModelsWithOMP.zip
Files
(192.5 MB)
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md5:327e8c2466b970859181c471c305b01b
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md5:5877178506344350b0a13f0224a7fda8
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md5:94a8e4067d64bd83473309ecfef7a16c
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md5:12766b17e638369da108cd30d251d342
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md5:b32c90403b1f26f2f3e238949241f1ce
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md5:9360d1646a24e6ebd65962cda9e80d40
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md5:b9e3fd31df46ee8f1c2024bd57dc6bb3
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8.2 kB | Preview Download |
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md5:6148d439af28e4cbeac274b398fb9011
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13.7 kB | Download |
Additional details
Related works
- Is new version of
- Dataset: 10.5281/zenodo.7881450 (DOI)