3F71

Crystal structure of E18D DJ-1 with oxidized C106

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 14-BM-C
Synchrotron site	APS
Beamline	14-BM-C
Temperature [K]	110
Detector technology	CCD
Collection date	2006-03-14
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9
Spacegroup name	P 31 2 1
Unit cell lengths	74.750, 74.750, 74.800
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 - 1.200
R-factor	0.1225
Rwork	0.122
R-free	0.15520
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1p5f
RMSD bond length	0.014
RMSD bond angle	0.030
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SHELX
Refinement software	SHELXL-97

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.240
High resolution limit [Å]	1.200	1.200
Rmerge	0.066	0.640
Number of reflections	75693
<I/σ(I)>	32	3.7
Completeness [%]	99.8	100
Redundancy	9.9	9.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	298	1.5 M sodium citrate, 25 mM HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K