4REY

Crystal Structure of the GRASP65-GM130 C-terminal peptide complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	200
Detector technology	CCD
Collection date	2013-12-09
Detector	ADSC QUANTUM 315
Spacegroup name	P 61
Unit cell lengths	129.725, 129.725, 37.104
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	64.860 - 1.960
R-factor	0.155
Rwork	0.152
R-free	0.19000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4kfv
RMSD bond length	0.018
RMSD bond angle	1.774
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASES
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.840	2.030
High resolution limit [Å]	1.960	1.960
Rmerge	0.103	0.481
Number of reflections	25936
<I/σ(I)>	13.78	4.39
Completeness [%]	99.6	100
Redundancy	13.1	13.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		8.5	291	30% PEG 4000, 0.1M Tris, 0.2M Lithium sulfate, , pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K