5DBX

Crystal structure of murine SPAK(T243D) in complex with AMPPNP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2007-10-31
Detector	CUSTOM-MADE
Wavelength(s)	0.97934
Spacegroup name	P 21 21 21
Unit cell lengths	66.442, 101.736, 104.077
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.329 - 2.500
R-factor	0.2083
Rwork	0.206
R-free	0.24570
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2c30
RMSD bond length	0.006
RMSD bond angle	1.027
Data reduction software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.540
High resolution limit [Å]	2.450	2.450
Rmerge	0.043	0.410
Number of reflections	27322
<I/σ(I)>	31.4
Completeness [%]	93.0
Redundancy	11.28

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 M Mg(OAc)2, 0.1 M Tris (pH 8.5), 16% PEG3350 (Hampton), 0.01 M Na- (CH3)2AsO2, and 0.01 M CaCl2