6SRB

Crystal structure of glutathione transferase Omega 3C from Trametes versicolor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-05
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.97625
Spacegroup name	C 1 2 1
Unit cell lengths	132.480, 54.320, 75.190
Unit cell angles	90.00, 94.13, 90.00

Refinement procedure

Resolution	47.894 - 1.650
R-factor	0.2079
Rwork	0.206
R-free	0.24480
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6hjs
RMSD bond length	0.011
RMSD bond angle	1.080
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.894	1.690
High resolution limit [Å]	1.650	1.650
Rmerge	0.034	0.430
Rmeas	0.042	0.550
Number of reflections	59292	4551
<I/σ(I)>	14.59	1.91
Completeness [%]	92.2	96.4
Redundancy	2.6
CC(1/2)	1.000	0.760

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH		277	15% (w/v) polyethylene glycol 8000 and 0.2 M ammonium sulfate