5U4Z

Crystal structure of citrus MAF1 in space group P 31 2 1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-11-16
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 31 2 1
Unit cell lengths	86.106, 86.106, 182.167
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	20.000 - 2.850
R-factor	0.1994
Rwork	0.198
R-free	0.23300
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.546
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELXDE
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	47.086	47.086	3.020
High resolution limit [Å]	2.850	8.430	2.850
Rmerge	0.214	0.037	2.668
Rmeas	0.225
Total number of observations	372748
Number of reflections	35279
<I/σ(I)>	10.94	53.04	1.05
Completeness [%]	100.0	99.4	99.9
Redundancy	9.4
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	5.6	291.15	1 M ammonium di-hydrogen phosphate, 0.1 M Tris-sodium pH 5.6, 10% glycerol