5JIX

PKG II's Carboxyl Terminal Cyclic Nucleotide Binding Domain (CNB-B) in a complex with 8-Br-cGMP

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]	100
Detector technology	CCD
Collection date	2015-04-16
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97741
Spacegroup name	P 21 21 21
Unit cell lengths	41.620, 52.090, 68.640
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.494 - 1.470
R-factor	0.1665
Rwork	0.165
R-free	0.18790
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5bv6
RMSD bond length	0.009
RMSD bond angle	1.305
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	41.494
High resolution limit [Å]	1.470
Rmerge	0.093
Number of reflections	25594
<I/σ(I)>	12.6
Completeness [%]	98.2
Redundancy	7.9
CC(1/2)	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	30% PEG 400, 200 mM CaAc, 0.1M NaAc pH 4.5-4.8