4A9W

Flavin-containing monooxygenase from Stenotrophomonas maltophilia

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-2
Synchrotron site	ESRF
Beamline	ID14-2
Temperature [K]	120
Detector technology	CCD
Collection date	2010-03-03
Detector	ADSC QUANTUM 4
Spacegroup name	P 32
Unit cell lengths	84.002, 84.002, 103.234
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	72.750 - 2.720
R-factor	0.18498
Rwork	0.182
R-free	0.23802
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3cty
RMSD bond length	0.016
RMSD bond angle	1.924
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	BALBES
Refinement software	REFMAC (5.6.0116)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	72.750	2.790
High resolution limit [Å]	2.720	2.720
Rmerge	0.130	0.550
Number of reflections	20682
<I/σ(I)>	7.5	2.4
Completeness [%]	1.0	100
Redundancy	3.8	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6		PROTEIN CONCENTRATION OF 4 MG ML-1. THE BEST CRYSTALS WERE ROUTINELY OBTAINED IN HANGING DROPS CONTAINING 0.9 M LITHIUM SULPHATE IN 100 MM BIS-TRIS PROPANE BUFFER AT PH 5.6.