8GC6

1.30 Angstroem crystal structure of the N-terminal domain of BqsR from Pseudomonas aeruginosa

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2022-02-27
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97872
Spacegroup name	P 41 21 2
Unit cell lengths	46.740, 46.740, 111.160
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.040 - 1.300
R-factor	0.1588
Rwork	0.158
R-free	0.17510
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.483
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.15_3459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.040	1.320
High resolution limit [Å]	1.300	1.300
Number of reflections	31130	1428
<I/σ(I)>	17.7
Completeness [%]	99.7
Redundancy	7.1
CC(1/2)	0.999	0.508

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	1 M sodium/potassium phosphate, pH 8.2