6F05

ARABIDOPSIS THALIANA GSTF9, GSO3 BOUND

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-07-29
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9795
Spacegroup name	P 1
Unit cell lengths	61.430, 93.970, 107.710
Unit cell angles	93.19, 101.57, 101.97

Refinement procedure

Resolution	65.731 - 2.200
R-factor	0.1638
Rwork	0.162
R-free	0.20930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ezy
RMSD bond length	0.008
RMSD bond angle	1.180
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	65.731	2.260
High resolution limit [Å]	2.200	2.200
Rmerge	0.070	0.600
Number of reflections	116579
<I/σ(I)>	10.67	2.08
Completeness [%]	97.8	97.1
Redundancy	2.3	2.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		273	0.1 M LiCl, 0.1 M Tris-HCl pH 8.0 and 15% PEG 8000