Nashed, Abdullateef https://orcid.org/0009-0008-5672-4688
Dilsook, Kyllen
Senapathi, Tharindu https://orcid.org/0000-0002-3277-4022
Naidoo, Kevin J. https://orcid.org/0000-0002-9898-3708
Article History
Received: 23 January 2025
Accepted: 6 April 2026
First Online: 22 April 2026
Competing interests
: K.J.N. declares that the structures identified through QM/MM trajectories in this work have potential commercial applications, including, amongst others, drug design and development. K.J.N intends to pursue intellectual property protection that may include this structural data; therefore, this has not been included in this publication as it is not central to the argument. K.J.N. declares that the reaction energetics provided are sufficient to support all experimental conclusions presented in this work. K.J.N. holds Struenodo shares. Struenodo provided experimental materials free of charge, as declared in the methods. All materials are commercially openly available. The remaining authors declare no competing interests.