| http://purl.uniprot.org/citations/34533923 | http://www.w3.org/1999/02/22-rdf-syntax-ns#type | http://purl.uniprot.org/core/Journal_Citation |
| http://purl.uniprot.org/citations/34533923 | http://www.w3.org/2000/01/rdf-schema#comment | "Mycobacterium tuberculosis dethiobiotin synthase (MtDTBS) is a crucial enzyme involved in the biosynthesis of biotin in the causative agent of tuberculosis, M. tuberculosis. Here, we report a binder of MtDTBS, cyclopentylacetic acid 2 (KD = 3.4 ± 0.4 mM), identified via in silico screening. X-ray crystallography showed that 2 binds in the 7,8-diaminopelargonic acid (DAPA) pocket of MtDTBS. Appending an acidic group to the para-position of the aromatic ring of the scaffold revealed compounds 4c and 4d as more potent binders, with KD = 19 ± 5 and 17 ± 1 μM, respectively. Further optimization identified tetrazole 7a as a particularly potent binder (KD = 57 ± 5 nM) and inhibitor (Ki = 5 ± 1 μM) of MtDTBS. Our findings highlight the first reported inhibitors of MtDTBS and serve as a platform for the further development of potent inhibitors and novel therapeutics for the treatment of tuberculosis."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.org/dc/terms/identifier | "doi:10.1021/acschembio.1c00491"xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Bruning J.B."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Lee K.J."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Booker G.W."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Abell A.D."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Pederick J.L."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Polyak S.W."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Salaemae W."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Thompson A.P."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Wegener K.L."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Avery T."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Gaiser B.I."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Hodgkinson-Bean J."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/author | "Schumann N.C."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/date | "2021"xsd:gYear |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/name | "ACS Chem Biol"xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/pages | "2339-2347"xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/title | "Inhibition of Mycobacterium tuberculosis Dethiobiotin Synthase (MtDTBS): Toward Next-Generation Antituberculosis Agents."xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://purl.uniprot.org/core/volume | "16"xsd:string |
| http://purl.uniprot.org/citations/34533923 | http://www.w3.org/2004/02/skos/core#exactMatch | http://purl.uniprot.org/pubmed/34533923 |
| http://purl.uniprot.org/citations/34533923 | http://xmlns.com/foaf/0.1/primaryTopicOf | https://pubmed.ncbi.nlm.nih.gov/34533923 |
| http://purl.uniprot.org/uniprot/#_P9WPQ5-mappedCitation-34533923 | http://www.w3.org/1999/02/22-rdf-syntax-ns#object | http://purl.uniprot.org/citations/34533923 |
| http://purl.uniprot.org/uniprot/P9WPQ5 | http://purl.uniprot.org/core/mappedCitation | http://purl.uniprot.org/citations/34533923 |