5MEE

Cyanothece lipoxygenase 2 (CspLOX2) variant - L304V

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	2014-05-12
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9184
Spacegroup name	P 21 21 21
Unit cell lengths	54.710, 167.100, 167.160
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.350 - 2.500
R-factor	0.194
Rwork	0.193
R-free	0.22000
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	5med
RMSD bond length	0.007
RMSD bond angle	0.761
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.350		2.600
High resolution limit [Å]	2.500	50.000	2.500
Rmerge	0.048		0.600
Number of reflections	53895
<I/σ(I)>	22.68		3.02
Completeness [%]	99.7		99.9
Redundancy	5.7
CC(1/2)	0.999		0.859

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.1	293	15% PEG 4000, 10% Glycerol, 0.1 M MES/immidazol pH 6.1