5YIP

Crystal Structure of AnkG LIR/GABARAPL1 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-10-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97774
Spacegroup name	P 64 2 2
Unit cell lengths	104.172, 104.172, 63.901
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.118 - 1.850
R-factor	0.1832
Rwork	0.181
R-free	0.22220
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2r2q
RMSD bond length	0.011
RMSD bond angle	1.113
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.880
High resolution limit [Å]	1.850	5.020	1.850
Rmerge	0.084	0.046
Rmeas	0.087	0.048
Rpim	0.022	0.012	0.280
Number of reflections	18077	1030	898
<I/σ(I)>	4.1
Completeness [%]	100.0	99.6	100
Redundancy	15.9	14	14.1
CC(1/2)		0.999	0.887

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	4.6	289	35% w/v Pentaerythritol ethoxylate 797 (15/4 EO/OH), 0.2 M ammonium sulfate, 0.1 M sodium acetate (pH 4.6)