5B6M

Crystal structure of human peroxiredoxin 6 in reduced state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 4A
Synchrotron site	PAL/PLS
Beamline	4A
Temperature [K]	100
Detector technology	CCD
Collection date	2010-03-10
Detector	ADSC QUANTUM 210
Wavelength(s)	1.00001
Spacegroup name	P 21 21 21
Unit cell lengths	94.353, 106.349, 165.504
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.893 - 2.496
R-factor	0.235
Rwork	0.233
R-free	0.28960
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2v2g
RMSD bond length	0.009
RMSD bond angle	1.307
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	CNS
Refinement software	PHENIX (1.8.2_1309)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.590
High resolution limit [Å]	2.496	2.500
Number of reflections	58546
<I/σ(I)>	25.2
Completeness [%]	98.9
Redundancy	9.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	100 mM magnesium formate, 18% polyethylene glycol 3350