6G77

RSK4 N-terminal Kinase Domain in complex with AMP-PNP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-06-30
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.9163
Spacegroup name	P 1 21 1
Unit cell lengths	51.143, 113.916, 62.183
Unit cell angles	90.00, 90.24, 90.00

Refinement procedure

Resolution	46.656 - 2.499
R-factor	0.1875
Rwork	0.185
R-free	0.23300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3g51
RMSD bond length	0.047
RMSD bond angle	1.359
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.660	2.588
High resolution limit [Å]	2.499	2.499
Rmerge	0.065	0.255
Rmeas	0.092
Number of reflections	23781	2409
<I/σ(I)>	9.31
Completeness [%]	9.0	96.98
Redundancy	1.9	1.9
CC(1/2)	0.992	0.828

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	291	20 % PEG 6000, 0.1 M TRIS pH8, 2 mM Zinc chloride