6XAF

1.9A crystal structure of the GTPase domain of Parkinson's disease-associated protein LRRK2 carrying R1398H

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-07
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	44.497, 101.785, 44.527
Unit cell angles	90.00, 101.38, 90.00

Refinement procedure

Resolution	20.048 - 1.968
R-factor	0.1834
Rwork	0.180
R-free	0.22140
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ojf
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.050	1.990
High resolution limit [Å]	1.960	1.960
Rmeas	0.115
Rpim	0.062
Number of reflections	27384	2565
<I/σ(I)>	13.64
Completeness [%]	99.3
Redundancy	3.3
CC(1/2)	0.968	0.862

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	6.5	298	100 mM potassium thiocyanate, 25% PEG2000 MME, 0.1 M Bis-Tris, pH 6.5