8B0V

Crystal structure of C-terminal domain of Pseudomonas aeruginosa LexA G91D mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-09-10
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9763
Spacegroup name	P 21 21 21
Unit cell lengths	41.894, 50.068, 105.273
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.920 - 1.700
Rwork	0.228
R-free	0.25400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1jhf
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.920	1.730
High resolution limit [Å]	1.700	1.700
Rmerge	0.072	1.072
Number of reflections	25087	1331
<I/σ(I)>	9.2
Completeness [%]	99.8	99.95
Redundancy	5.1
CC(1/2)	0.998	0.721

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.2M CaCl2, 0.1M MES pH 6.0, 20%w/v PEG 6000, 2.5 mM Tb-Xo4 (Crystallophore 1)