Structural Filtering Identifies Candidate Rheostat Positions Across Enzyme Systems

Zenodo (CERN European Organization for Nuclear Research)

Abstract

Raw data supporting the manuscript 'Structural Filtering Identifies Candidate Rheostat Positions Across Enzyme Systems' (PLOS ONE, under review; Manuscript No. PONE-D-26-24892). Includes multiple sequence alignments (CS_MSA.fasta, OTUD6B_MSA.fasta, DDAH2_MSA.fasta), BLASTP XML outputs (CS.xml, OTUD6B.xml, DDAH2.xml), EVcouplings co-evolutionary coupling data for all three enzymes (CSV format), and FoldX alanine scanning output for citrate synthase, OTUD6B, and DDAH2.

Authors 5

1. J Chander

   Illinois Institute of Technology

   Affiliation as printed

   Illinois Institute of Technology

2. Alexander Julian

   Illinois Institute of Technology

   Affiliation as printed

   Illinois Institute of Technology

3. S Lee

   Illinois Institute of Technology

   Affiliation as printed

   Illinois Institute of Technology

4. Andrew Howard

   Illinois Institute of Technology · "Institute" Energosetproject"

   Affiliation as printed

   Illinois Institute of Technoloy

   "Institute" Energosetproject"

5. Rosan C.M. Kuin Aachen

   Leiden University

   Affiliation as printed

   Leiden University