7QA3
Crystal structure of PqsR (MvfR) ligand-binding domain in complex with compound N-((2-(4-phenoxyphenyl)thiazol-5-yl)methyl)-2-(trifluoromethyl)pyridin-4-amine
Summary for 7QA3
Entry DOI | 10.2210/pdb7qa3/pdb |
Descriptor | Multiple virulence factor regulator MvfR, N-[[2-(4-phenoxyphenyl)-1,3-thiazol-5-yl]methyl]-2-(trifluoromethyl)pyridin-4-amine (3 entities in total) |
Functional Keywords | quorum sensing, lysr-type transcriptional regulator, pseudomonas, 2 quinolone signaling system, lttr, dna binding protein, gene regulation |
Biological source | Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1) |
Total number of polymer chains | 2 |
Total formula weight | 75369.84 |
Authors | Schmelz, S.,Blankenfeldt, W. (deposition date: 2021-11-15, release date: 2022-11-23, Last modification date: 2024-06-12) |
Primary citation | Abdelsamie, A.S.,Hamed, M.M.,Schutz, C.,Rohrig, T.,Kany, A.M.,Schmelz, S.,Blankenfeldt, W.,Hirsch, A.K.H.,Hartmann, R.W.,Empting, M. Discovery and Optimization of Thiazole-Based Quorum Sensing Inhibitors as Potent Blockers of Pseudomonas Aeruginosa Pathogenicity Ssrn, 2024 Cited by DOI: 10.2139/ssrn.4789988PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.67 Å) |
Structure validation
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