4IJ5

Crystal Structure of a Novel-type Phosphoserine Phosphatase from Hydrogenobacter thermophilus TK-6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	CCD
Collection date	2011-07-22
Detector	MAR225HE
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	49.810, 73.630, 124.280
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.100 - 1.500
R-factor	0.1843
Rwork	0.184
R-free	0.19660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1h2e
RMSD bond length	0.008
RMSD bond angle	1.272
Data reduction software	XDS
Data scaling software	XDS
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall
Low resolution limit [Å]	36.100
High resolution limit [Å]	1.500
Number of reflections	73612
Redundancy	8.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	100mM HEPES-NaOH, 10%(v/v) 2-propanol, 20%(w/v) polyethylene glycol 4000, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K