Tailoring the specificity of the type C feruloyl esterase FoFaeC from Fusarium oxysporum towards methyl sinapate by rational redesign based on small molecule docking simulations

• Io Antonopoulou ,

  Contributed equally to this work with: Io Antonopoulou, Cameron Hunt

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Project administration, Software, Validation, Visualization, Writing – original draft, Writing – review & editing

  Affiliation Biochemical Process Engineering, Division of Chemical Engineering, Department of Civil, Environmental and Natural Resources Engineering, Luleå University of Technology, Luleå, Sweden

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• Cameron Hunt ,

  Contributed equally to this work with: Io Antonopoulou, Cameron Hunt

  Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Software, Validation, Visualization, Writing – review & editing

  Affiliation Biochemical Process Engineering, Division of Chemical Engineering, Department of Civil, Environmental and Natural Resources Engineering, Luleå University of Technology, Luleå, Sweden

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• Gabriella Cerullo,

  Roles Data curation, Formal analysis, Investigation, Methodology

  Affiliation Department of Chemical Sciences, University of Naples “Federico II”, Naples, Italy

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• Simona Varriale,

  Roles Data curation, Formal analysis, Methodology

  Affiliation Department of Chemical Sciences, University of Naples “Federico II”, Naples, Italy

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• Alexandra Gerogianni,

  Roles Data curation, Formal analysis

  Affiliation Biochemical Process Engineering, Division of Chemical Engineering, Department of Civil, Environmental and Natural Resources Engineering, Luleå University of Technology, Luleå, Sweden

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• Vincenza Faraco,

  Roles Funding acquisition, Project administration, Resources, Supervision

  Affiliation Department of Chemical Sciences, University of Naples “Federico II”, Naples, Italy

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• Ulrika Rova,

  Roles Funding acquisition, Project administration, Supervision

  Affiliation Biochemical Process Engineering, Division of Chemical Engineering, Department of Civil, Environmental and Natural Resources Engineering, Luleå University of Technology, Luleå, Sweden

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• Paul Christakopoulos

  Roles Funding acquisition, Project administration, Resources, Supervision, Writing – review & editing

  * E-mail: paul.christakopoulos@ltu.se

  Affiliation Biochemical Process Engineering, Division of Chemical Engineering, Department of Civil, Environmental and Natural Resources Engineering, Luleå University of Technology, Luleå, Sweden

  http://orcid.org/0000-0002-7754-9398

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