W254 in furin functions as a molecular gate: elucidation of putative drug tunneling and docking by non-equilibrium molecular dynamics

Ridgway, Harry, Orbell, John ORCID: 0000-0003-3485-5309, Matsoukas, Minos-Timotheos ORCID: 0000-0002-4642-8163, Kelaidonis, Konstantinos, Moore, Graham J, Tsiodras, Sotiris, Apostolopoulos, Vasso ORCID: 0000-0001-6788-2771, Chasapis, Christos T ORCID: 0000-0002-8728-6245, Gorgoulis, Vasilis G and Matsoukas, John ORCID: 0000-0001-5554-2964 (2023) W254 in furin functions as a molecular gate: elucidation of putative drug tunneling and docking by non-equilibrium molecular dynamics. Computational and Structural Biotechnology Journal. ISSN 2001-0370

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Item type Article
URI https://vuir.vu.edu.au/id/eprint/47203
DOI 10.1016/j.csbj.2023.09.003
Official URL https://www.sciencedirect.com/science/article/pii/...
Subjects Current > Division/Research > Australian Institute of Musculoskeletal Science (AIMSS)
Current > Division/Research > Institute for Health and Sport
Current > Division/Research > Institute for Sustainable Industries and Liveable Cities
Keywords furin, endoproteases, process precursor proteins, biology, antimicrobial, antiviral
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