5HE3

Bovine GRK2 in complex with Gbetagamma subunits and CCG224411

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-G
Synchrotron site	APS
Beamline	21-ID-G
Temperature [K]	100
Detector technology	CCD
Collection date	2015-07-16
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97857
Spacegroup name	C 2 2 21
Unit cell lengths	60.031, 239.412, 208.625
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.740
R-factor	0.1981
Rwork	0.195
R-free	0.25710
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.567
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	2.850
High resolution limit [Å]	2.800	7.560	2.800
Rmerge	0.104	0.051	0.936
Rmeas	0.114	0.057
Rpim	0.053	0.026	0.486
Total number of observations	168944
Number of reflections	36395
<I/σ(I)>	8.1
Completeness [%]	93.3	96.8	93.5
Redundancy	4.6	4.3	4.5
CC(1/2)		0.996	0.769

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	277	50 mM MES, 0.8-1.2 M sodium chloride, 8-16% PEG3350