3SP4

Crystal structure of aprataxin ortholog Hnt3 from Schizosaccharomyces pombe

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2010-05-18
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9789
Spacegroup name	P 21 21 21
Unit cell lengths	53.177, 70.201, 107.809
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.856 - 1.800
R-factor	0.187
Rwork	0.185
R-free	0.22480
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	0.975
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SOLVE
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.860
High resolution limit [Å]	1.800	1.800
Rmerge	0.085	0.347
Number of reflections	36873
<I/σ(I)>	19	4.1
Completeness [%]	96.6	80.7
Redundancy	6.5	5.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	289	20% PEG 3350, 0.1M Tris-HCl, pH8.0, 0.1M Li2SO4 , VAPOR DIFFUSION, SITTING DROP, temperature 289K