dc.contributor.author | Irsheid, Lina | en_US |
dc.contributor.author | Wehler, Thomas | en_US |
dc.contributor.author | Borek, Christoph | en_US |
dc.contributor.author | Kiefer, Werner | en_US |
dc.contributor.author | Brenk, Ruth | en_US |
dc.contributor.author | Ortiz-Soto, Maria Elena | en_US |
dc.contributor.author | Seibel, Jurgen | en_US |
dc.contributor.author | Schirmeister, Tanja | en_US |
dc.date.accessioned | 2020-08-07T12:38:12Z | |
dc.date.available | 2020-08-07T12:38:12Z | |
dc.date.issued | 2019-05-08 | |
dc.Published | Irsheid, Wehler T, Borek, Kiefer, Brenk R, Ortiz-Soto, Seibel, Schirmeister. Identification of a potential allosteric site of Golgi α-mannosidase II using computer-aided drug design. PLOS ONE. 2019;14(5):e0216132 | eng |
dc.identifier.issn | 1932-6203 | |
dc.identifier.uri | https://hdl.handle.net/1956/23570 | |
dc.description.abstract | Golgi α-mannosidase II (GMII) is a glycoside hydrolase playing a crucial role in the N-glycosylation pathway. In various tumour cell lines, the distribution of N-linked sugars on the cell surface is modified and correlates with the progression of tumour metastasis. GMII therefore is a possible molecular target for anticancer agents. Here, we describe the identification of a non-competitive GMII inhibitor using computer-aided drug design methods including identification of a possible allosteric binding site, pharmacophore search and virtual screening. | en_US |
dc.language.iso | eng | eng |
dc.publisher | PLoS | eng |
dc.rights | Attribution CC BY | eng |
dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | eng |
dc.title | Identification of a potential allosteric site of Golgi α-mannosidase II using computer-aided drug design | en_US |
dc.type | Peer reviewed | |
dc.type | Journal article | |
dc.date.updated | 2019-11-15T11:44:23Z | |
dc.description.version | publishedVersion | en_US |
dc.rights.holder | Copyright 2019 The Authors | |
dc.identifier.doi | https://doi.org/10.1371/journal.pone.0216132 | |
dc.identifier.cristin | 1713716 | |
dc.source.journal | PLoS ONE | |