5EY6

CRYSTAL STRUCTURE OF GLUTATHIONE TRANSFERASE F2 FROM POPULUS TRICHOCARPA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM30A
Synchrotron site	ESRF
Beamline	BM30A
Temperature [K]	100
Detector technology	CCD
Collection date	2013-11-28
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.997967
Spacegroup name	P 21 21 2
Unit cell lengths	96.383, 83.316, 60.052
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.658 - 1.900
R-factor	0.1948
Rwork	0.193
R-free	0.22780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ri6
RMSD bond length	0.006
RMSD bond angle	0.977
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.720	2.000
High resolution limit [Å]	1.900	1.900
Rmerge	0.064	0.475
Number of reflections	38738
<I/σ(I)>	22.9	4.3
Completeness [%]	99.8	99.4
Redundancy	7.3	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	6.5	277	30% PEG MME 2000, 0.1 M Na acetate, Na MES pH6.5