6QUQ

Crystal structure of glutathionylated glycolytic glyceraldehyde-3- phosphate dehydrogenase from Arabidopsis thaliana (AtGAPC1)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ELETTRA BEAMLINE 5.2R
Synchrotron site	ELETTRA
Beamline	5.2R
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-05-15
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.26
Spacegroup name	P 61 2 2
Unit cell lengths	77.365, 77.365, 406.814
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.657 - 2.993
R-factor	0.2513
Rwork	0.249
R-free	0.30310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4z0h
RMSD bond length	0.010
RMSD bond angle	1.402
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.660	3.160
High resolution limit [Å]	2.990	2.990
Rmerge	0.088	0.303
Rmeas	0.091	0.311
Rpim	0.021	0.070
Number of reflections	15692	2155
<I/σ(I)>	25.1	9.1
Completeness [%]	99.7	98
Redundancy	18.7	19.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	3.0 M (NH4)2SO4, 0.1 M Hepes-NaOH, 0.1 mM H2O2 and 1 mM GSH