#diseaseswithcomputationalchemistry

Structural and catalytic consequences of active-site vs. distal mutations in human dehalogenase: insights from molecular dynamics simulations Congenital hypothyroidism can result from mutations in human iodotyrosine deiodinase (hIYD), which catalyzes the deiodination of iodotyrosines (I-Tyr), a key step in thyroid hormone synthesis. Three…

Research : doi.org/10.1039/D5CP...
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#congenitalhypothyroidism #diseaseswithcomputationalchemistry #humaniodotyrosinedeiodinase #moleculardynamicssimulation #qmmmcalculations