5IG3

Crystal structure of the human CaMKII-alpha hub

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-07-16
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 43 21 2
Unit cell lengths	89.888, 89.888, 226.577
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.631 - 2.750
R-factor	0.2225
Rwork	0.220
R-free	0.26840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1hkx
RMSD bond length	0.002
RMSD bond angle	0.505
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.640	2.900
High resolution limit [Å]	2.750	2.750
Rmerge	0.079	1.124
Number of reflections	25096
<I/σ(I)>	14.4	2.1
Completeness [%]	100.0	100
Redundancy	7.9	7.6
CC(1/2)	0.946

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.3	295	35 % (v/v) MPD, 0.1 M HEPES pH 7.3