TY  - JOUR 
AU  - Bui, Soi
AU  - Gil-Guerrero, Sara
AU  - van der Linden, Peter
AU  - Carpentier, Philippe
AU  - Ceccarelli, Matteo
AU  - García Jambrina, Pablo
AU  - Steiner, Roberto A.
PY  - 2023
SN  - 2041-6520
UR  - http://hdl.handle.net/10366/166362
AB  - [EN] Protein fold adaptation to novel enzymatic reactions is a fundamental evolutionary process. Cofactor-independent oxygenases degrading N-heteroaromatic substrates belong to the α/β-hydrolase (ABH) fold superfamily that typically does not catalyze...
LA  - eng
PB  - The Royal Society of Chemistry
KW  - Intersystem crossing
KW  - Computational chemistry
KW  - Molecular dynamics
KW  - QM/MM
TI  - Evolutionary adaptation from hydrolytic to oxygenolytic catalysis at the α/β-hydrolase fold
DO  - 10.1039/D3SC03044J
T2  - Chemical Science
VL  - 14
M2  - 10547
ER  -