3JYL

Crystal structures of Pseudomonas syringae pv. Tomato DC3000 quinone oxidoreductase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2009-05-09
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 31 2 1
Unit cell lengths	63.560, 63.560, 130.149
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	23.240 - 2.400
R-factor	0.2044
Rwork	0.202
R-free	0.24862
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1qor
RMSD bond length	0.008
RMSD bond angle	1.330
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	CNS (1.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	23.240	2.490
High resolution limit [Å]	2.400	2.400
Rmerge	0.095	0.530
Number of reflections	12429
<I/σ(I)>	15.3	3.8
Completeness [%]	100.0	100
Redundancy	7.1	7.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	0.1M Tris-HCl(pH 8.5), 0.2M MgCl2, 30%PEG4000, VAPOR DIFFUSION, SITTING DROP, temperature 291K