Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Case Study Binding of Biotin Analogs to Avidin

6 Case Study Binding of Biotin Analogs to Avidin [Pg.452]

Synopsis of Kuhn and Kollman (2000) A Ligand Tliat Is Predicted to Bind Better to Avidin than Biotin Insights from Computational Fluorine Scanning . [Pg.452]

The trajectory is then post-processed to determine absolute free energies in solution for biotin, avidin, and the avidin-biotin complex. This process begins by stripping the water from the trajectory, and then computing absolute free energy as [Pg.452]

Only the force-field energy term associated with interactions between the biotin and avidin fragments remains. This is added to the differential solvation free energies and differential thermal terms to determine the full binding free energy. [Pg.453]

CASE STUDY BINDING OF BIOTIN ANALOGS TO AVIDIN... [Pg.453]



SEARCH



Analog Studies

Avidin

Avidin binding

Avidin-biotin

Binding study

Biotin-avidin binding

Of -biotin

© 2024 chempedia.info