7YKH

Crystal structure of MAGI2 PDZ0-GK domain in complex with phospho-SAPAP1 GBR2 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2013-08-28
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97917
Spacegroup name	P 1 21 1
Unit cell lengths	55.212, 61.540, 65.104
Unit cell angles	90.00, 101.79, 90.00

Refinement procedure

Resolution	40.609 - 2.500
R-factor	0.2071
Rwork	0.204
R-free	0.26440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2eeh 5ypo
RMSD bond length	0.008
RMSD bond angle	1.161
Data reduction software	DENZO
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.8_1069)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.540
High resolution limit [Å]	2.500	6.780	2.500
Rmerge	0.107	0.056	0.629
Total number of observations	108108
Number of reflections	14863	779	723
<I/σ(I)>	8.8
Completeness [%]	99.7	98.7	99.9
Redundancy	7.3	6.9	7.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	25% w/v PEG 3350, 0.1 M HEPES (pH 7.5)