2YYH

Crystal structure of Nudix family protein from Aquifex aeolicus

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B2
Synchrotron site	SPring-8
Beamline	BL26B2
Temperature [K]	100
Detector technology	CCD
Collection date	2006-05-16
Detector	RIGAKU JUPITER 210
Wavelength(s)	0.97894, 0.9000, 0.97935
Spacegroup name	C 1 2 1
Unit cell lengths	122.020, 34.336, 130.005
Unit cell angles	90.00, 106.06, 90.00

Refinement procedure

Resolution	39.500 - 1.800
R-factor	0.211
Rwork	0.211
R-free	0.24800
Structure solution method	MAD
RMSD bond length	0.010
RMSD bond angle	2.000
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SOLVE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.860
High resolution limit [Å]	1.800	1.800
Number of reflections	91555
<I/σ(I)>	18	1.96
Completeness [%]	98.5	91
Redundancy	2.75

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.7	293	0.16M LiCl, 16% PEG3350, pH 6.7, VAPOR DIFFUSION, SITTING DROP, temperature 293K