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Conformational dynamics promotes disordered regions from function-dispensable to essential in evolved site-specific DNA recombinases

Computational and Structural Biotechnology Journal(2022)

Cited 3|Views11
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Abstract
•New functional regions emerging in evolution of DNA site-specific recombinase tails.•Transient structural nucleation promotes function-dispensable regions to essential.•Molecular dynamics reveals conformational diversity and its functional implications.•Evolved disordered molecular mechanisms of N-term tails for protein stability.•Structural disorder-based link between protein evolution, stability and function.
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Key words
Intrinsically disordered protein regions,site-specific DNA recombinase,Evolution,Molecular dynamics,Structural disorder,Thermodynamic stability,AI-based folding
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