6BDL

Crystal structure of cGMP-dependent protein kinase Ialpha (PKG Ialpha) catalytic domain in apo state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	77
Detector technology	CCD
Collection date	2016-11-16
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97741
Spacegroup name	P 1 2 1
Unit cell lengths	85.114, 50.879, 85.531
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.100 - 1.960
R-factor	0.2092
Rwork	0.209
R-free	0.22170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3fjq
RMSD bond length	0.005
RMSD bond angle	0.677
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHENIX (1.12_2829)
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.100	2.010
High resolution limit [Å]	1.960	1.960
Rmerge	0.076	0.613
Number of reflections	52831	3706
<I/σ(I)>	9.2	1.9
Completeness [%]	99.7	99.9
Redundancy	4.7	4.7
CC(1/2)	0.998	0.841

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	295	0.1 M PCTP, pH6.0, 25% w/v PEG1500