6FHO

Crystal structure of pqsL, a probable FAD-dependent monooxygenase from Pseudomonas aeruginosa - new refinement

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	100
Detector technology	CCD
Collection date	2008-12-14
Detector	ADSC QUANTUM 4
Wavelength(s)	0.939
Spacegroup name	P 21 21 21
Unit cell lengths	47.077, 63.257, 128.628
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.670 - 1.750
R-factor	0.18171
Rwork	0.180
R-free	0.21875
RMSD bond length	0.020
RMSD bond angle	2.035
Data reduction software	XDS
Data scaling software	XSCALE
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.670	1.800
High resolution limit [Å]	1.750	1.750
Rmerge	0.080	0.740
Number of reflections	37305
<I/σ(I)>	2.28	2.28
Completeness [%]	99.5	95
Redundancy	5.3	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	31% PEG1500, 0.1M HEPES, PH 7.5. CRYSTALS WERE CRYOPROTECTED WITH 10% PEG400 IN A SOLUTION CONTAINING 35% PEG1500, 0.1M HEPES, PH 7.5