RT Journal Article T1 Enzyme Conformation Influences the Performance of Lipase‐powered Nanomotors A1 Wang, Lei A1 Marciello, Marzia A1 Estévez‐Gay, Miquel A1 Soto Rodríguez, Paul A1 Luengo Morato, Yurena A1 Iglesias‐Fernández, Javier A1 Huang, Xin A1 Osuna, Sílvia A1 Filice, Marco A1 Sánchez, Samuel AB Enzyme-powered micro/nanomotors have myriads of potential applications in various areas. To efficiently reach those applications, it is necessary and critical to understand the fundamental aspects affecting the motion dynamics. Herein, we explored the impact of enzyme orientation on the performance of lipase-powered nanomotors by tuning the lipase immobilization strategies. The influence of the lipase orientation and lid conformation on substrate binding and catalysis was analyzed using molecular dynamics simulations. Besides, the motion performance indicates that the hydrophobic binding (via OTES) represents the best orienting strategy, providing 48.4 % and 95.4 % increase in diffusion coefficient compared to hydrophilic binding (via APTES) and Brownian motion (no fuel), respectively (with C[triacetin] of 100 mm). This work provides vital evidence for the importance of immobilization strategy and corresponding enzyme orientation for the catalytic activity and in turn, the motion performance of nanomotors, and is thus helpful to future applications. SN 1433-7851 YR 2020 FD 2020-09-16 LK https://hdl.handle.net/20.500.14352/100718 UL https://hdl.handle.net/20.500.14352/100718 LA eng NO Wang, Lei, et al. «Enzyme Conformation Influences the Performance of Lipase‐powered Nanomotors». Angewandte Chemie International Edition, vol. 59, n.o 47, noviembre de 2020, pp. 21080-87. DOI.org (Crossref), https://doi.org/10.1002/anie.202008339. NO Fundación Nacional de Ciencias Naturales de China NO Marie Sklodowska-Curie Fellowship NO Special Funded Project of China Postdoctoral Science Foundation NO Comunidad de Madrid NO Federación Española de Enfermedades Raras NO Ministerio de Economía, Comercio y Empresa (España) NO Generalitat de Catalunya NO European Research Council NO Universidad Complutense de Madrid NO Pro-CNIC Foundation NO Ministerio de Ciencia, Innovación y Universidades (España) NO Agencia Estatal de Investigación DS Docta Complutense RD 17 abr 2025