Accurate prediction by AlphaFold2 for ligand binding in a reductive dehalogenase: Implications for PFAS (per- and polyfluoroalkyl substance) biodegradation
Preprint
- 20 September 2022
- preprint
- Published by Research Square Platform LLC
Abstract
Despite the success of AlphaFold2 (AF2), it is unclear how AF2 models accommodate for ligand binding. Here, we start with a protein sequence from Acidimicrobiaceae TMED77 (T7RdhA) with potential for catalyzing the degradation of per- and polyfluoroalkyl substances (PFASs). AF2 models ...Keywords
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- Published version: Version Scientific Reports, 13, preprints
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