PROTAC Ternary Models: Brd4bd1-zxh327/zxh2147/zxh2184/zxh326/dbet70-CRBN

Published: 22 December 2020| Version 1 | DOI: 10.17632/54hp53tfmt.1
Contributors:
Nan Bai, John Karanicolas

Description

This dataset contains all ternary models of system: Brd4bd1-zxh327/zxh2147/zxh2184/zxh326/dbet70-CRBN. All ternary models pass two filters: linker rmsd (geometry) and Rosetta minimization energy (energy). As no ternary model of PROTAC zxh-3-27 passed the two filters, there is no folder named zxh327. The score.zip contains all Rosetta minimization Inter_E scores of all ternary models.

Files

Institutions

Fox Chase Cancer Center

Categories

Computational Biology

Related Links

Article
https://doi.org/10.1038/s41589-018-0055-y
is cited by this dataset

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