| http://purl.uniprot.org/citations/15050823 | http://www.w3.org/1999/02/22-rdf-syntax-ns#type | http://purl.uniprot.org/core/Journal_Citation |
| http://purl.uniprot.org/citations/15050823 | http://www.w3.org/2000/01/rdf-schema#comment | "The enzyme tRNA-guanine transglycosylase (TGT) is involved in the pathogenicity of Shigellae. As the crystal structure of this protein is known, it is a putative target for the structure-based design of inhibitors. Here we report a crystallographic study of several new ligands exhibiting a 2,6-diamino-3H-quinazolin-4-one scaffold, which has been shown recently to be a promising template for TGT-inhibitors. Crystal structure analysis of these complexes has revealed an unexpected movement of the side-chain of Asp102. A detailed analysis of the water network disrupted by this rotation has lead to the derivation of a new composite pharmacophore. A virtual screening has been performed based on this pharmacophore hypothesis and several new inhibitors of micromolar binding affinity with new skeletons have been discovered."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.org/dc/terms/identifier | "doi:10.1016/j.jmb.2004.02.019"xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/author | "Reuter K."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/author | "Stubbs M.T."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/author | "Klebe G."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/author | "Brenk R."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/author | "Diederich F."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/author | "Garcia G.A."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/author | "Meyer E.A."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/date | "2004"xsd:gYear |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/name | "J Mol Biol"xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/pages | "55-75"xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/title | "Crystallographic study of inhibitors of tRNA-guanine transglycosylase suggests a new structure-based pharmacophore for virtual screening."xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://purl.uniprot.org/core/volume | "338"xsd:string |
| http://purl.uniprot.org/citations/15050823 | http://www.w3.org/2004/02/skos/core#exactMatch | http://purl.uniprot.org/pubmed/15050823 |
| http://purl.uniprot.org/citations/15050823 | http://xmlns.com/foaf/0.1/primaryTopicOf | https://pubmed.ncbi.nlm.nih.gov/15050823 |
| http://purl.uniprot.org/uniprot/#_P28720-mappedCitation-15050823 | http://www.w3.org/1999/02/22-rdf-syntax-ns#object | http://purl.uniprot.org/citations/15050823 |
| http://purl.uniprot.org/uniprot/P28720 | http://purl.uniprot.org/core/mappedCitation | http://purl.uniprot.org/citations/15050823 |