8CR7

Crystal structure of recombinant LasB from Pseudomonas aeruginosa PA7

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-01-25
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.8856
Spacegroup name	P 1 21 1
Unit cell lengths	61.156, 64.274, 73.401
Unit cell angles	90.00, 108.09, 90.00

Refinement procedure

Resolution	43.110 - 1.500
R-factor	0.1651
Rwork	0.164
R-free	0.18930
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.184
Data reduction software	autoPROC
Data scaling software	pointless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.110	1.530
High resolution limit [Å]	1.500	1.500
Rmerge	0.061	0.365
Rmeas	0.076	0.449
Rpim	0.044	0.258
Number of reflections	242845	4239
<I/σ(I)>	9.7
Completeness [%]	99.4
Redundancy	2.8
CC(1/2)	0.995	0.868

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2 M magnesium acetate, 0.1 M sodium cacodylate pH 6.5, 30% (v/v) MPD