Article

Comparative Study of Stability and Activity of Wild-Type and Mutant Human Carbonic Anhydrase II Enzymes Using Molecular Dynamics and Docking Simulations

2024-03-13

Abstract excerpt

The human carbonic anhydrase II (HCA II) enzyme is a cytosolic protein located in the membrane of red blood cells. A zinc ion (Zn 2+ ) in this enzyme makes it an excellent example of a metalloenzyme that reversible hydration of carbon dioxide (CO 2 ). Considering the critical role of the HCA II, computational methods such as molecular docking, molecular dynamics (MD) simulation, and molecular mechanic/Poisen-Boltz...

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Literature Corpus work: 8f49f7a6-e70a-54ea-bcee-b44c3b979ef6
DOI: 10.21203/rs.3.rs-3950521/v1

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