5J0A

Crystal structure of PDZ-binding kinase

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	2010-03-15
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9791
Spacegroup name	P 21 21 21
Unit cell lengths	75.558, 97.905, 162.835
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.760 - 2.740
R-factor	0.222
Rwork	0.222
R-free	0.27100
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	1.300
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	CNS (1.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	32.760	2.870
High resolution limit [Å]	2.740	2.740
Number of reflections	32541

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.2 M lithium sulfate, 2.0 M ammonium sulfate, 0.1 M CAPS