Conformational Landscape of a Marginally Disordered Protein HYPK and its Charge-Variant Mutant in the Context of Folded Domains
All-atom molecular dynamics simulations are used to understand the sequence-specific and structural origin of marginality in HYPK by investigating the conformation landscape of both the wild-type and a charge-variant mutant of HYPK, with and without fluorescent proteins attached at the N- and C- termini.