5VWC

Crystal structure of human Scribble PDZ1 domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-07-20
Detector	ADSC QUANTUM 210
Wavelength(s)	0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	35.490, 41.693, 51.570
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.422 - 1.911
R-factor	0.197
Rwork	0.195
R-free	0.22680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2w4f
RMSD bond length	0.008
RMSD bond angle	0.923
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.690	1.950
High resolution limit [Å]	1.910	1.910
Rmerge	0.076	0.425
Number of reflections	6245	2229
<I/σ(I)>	16.2	4.5
Completeness [%]	99.3	95.6
Redundancy	5.7	5.7
CC(1/2)	0.999	0.856

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	20% (w/v) polyethylene glycol 3350, 0.2M magnesium chloride hexahydrate