5W6J

Agrobacterium tumefaciens ADP-glucose pyrophosphorylase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	80
Detector technology	CCD
Collection date	2015-04-15
Detector	MARRESEARCH
Wavelength(s)	0.98
Spacegroup name	P 1
Unit cell lengths	93.439, 140.685, 228.490
Unit cell angles	72.04, 78.19, 89.98

Refinement procedure

Resolution	36.550 - 1.780
R-factor	0.202
Rwork	0.200
R-free	0.22900
RMSD bond length	0.007
RMSD bond angle	0.763
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.810
High resolution limit [Å]	1.780	4.830	1.780
Rmerge	0.049	0.023	0.729
Rmeas	0.067	0.032
Rpim	0.049	0.023	0.729
Total number of observations	1967391
Number of reflections	1003131
<I/σ(I)>	8.2
Completeness [%]	97.3	95.8	96.1
Redundancy	2	2	2
CC(1/2)		0.998	0.561

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	50mM HEPES pH 7.5, 1.5M Li2SO4