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Tuning the populations of the enzyme conformational states through mutation enables evolution towards novel activity. Herein, Markov state models are used to unveil hidden conformational states of monoamine oxidase from Aspergillus niger (MAO\u2010N). These hidden conformations, not previously observed by any other technique, play a crucial role in substrate binding and enzyme activity. This reveals how distal mutations regulate MAO\u2010N activity by stabilizing these hidden, catalytically important conformational states, but also by modulating the communication pathway between both MAO\u2010N subunits.<\/jats:p>","DOI":"10.1002\/anie.201812532","type":"journal-article","created":{"date-parts":[[2019,1,2]],"date-time":"2019-01-02T04:44:59Z","timestamp":1546404299000},"page":"3097-3101","update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":41,"title":["Hidden Conformations in\n                    <i>Aspergillus niger<\/i>\n                    Monoamine Oxidase are Key for Catalytic Efficiency"],"prefix":"10.1002","volume":"58","author":[{"given":"Christian","family":"Curado\u2010Carballada","sequence":"first","affiliation":[{"name":"Institut de Qu\u00edmica Computacional i Cat\u00e0lisi (IQCC) Departament de Qu\u00edmica  Carrer Maria Aur\u00e8lia Capmany 69 17003 Girona Catalonia Spain"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ferran","family":"Feixas","sequence":"additional","affiliation":[{"name":"Institut de Qu\u00edmica Computacional i Cat\u00e0lisi (IQCC) Departament de Qu\u00edmica  Carrer Maria Aur\u00e8lia Capmany 69 17003 Girona Catalonia Spain"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Javier","family":"Iglesias\u2010Fern\u00e1ndez","sequence":"additional","affiliation":[{"name":"Institut de Qu\u00edmica Computacional i Cat\u00e0lisi (IQCC) Departament de Qu\u00edmica  Carrer Maria Aur\u00e8lia Capmany 69 17003 Girona Catalonia Spain"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3657-6469","authenticated-orcid":false,"given":"S\u00edlvia","family":"Osuna","sequence":"additional","affiliation":[{"name":"Institut de Qu\u00edmica Computacional i Cat\u00e0lisi (IQCC) Departament de Qu\u00edmica  Carrer Maria Aur\u00e8lia Capmany 69 17003 Girona Catalonia Spain"},{"name":"ICREA  Pg. 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