6Q7V

Crystal structure of PqsR (MvfR) ligand-binding domain in complex with compound 11

Summary for 6Q7V

Entry DOI	10.2210/pdb6q7v/pdb
Descriptor	Transcriptional regulator MvfR, ~{N}4-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)pyridine-2,4-diamine (3 entities in total)
Functional Keywords	quorum sensing, lysr-type transcriptional regulator, pseudomonas quinolone signaling system, lttr, dna binding protein
Biological source	Pseudomonas aeruginosa PAO1
Total number of polymer chains	2
Total formula weight	51970.62
Authors	Witzgall, F.,Blankenfeldt, W. (deposition date: 2018-12-13, release date: 2019-11-20, Last modification date: 2024-01-24)
Primary citation	Zender, M.,Witzgall, F.,Kiefer, A.,Kirsch, B.,Maurer, C.K.,Kany, A.M.,Xu, N.,Schmelz, S.,Borger, C.,Blankenfeldt, W.,Empting, M. Flexible Fragment Growing Boosts Potency of Quorum-Sensing Inhibitors against Pseudomonas aeruginosa Virulence. Chemmedchem, 15:188-194, 2020 Cited by PubMed: 31709767 DOI: 10.1002/cmdc.201900621 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.56 Å)

Structure validation