3CBZ

The Dvl2 PDZ Domain in Complex with the N2 Inhibitory Peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	2006-06-09
Detector	ADSC QUANTUM 315
Wavelength(s)	1.00
Spacegroup name	P 21 21 21
Unit cell lengths	42.675, 43.554, 54.860
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 1.380
R-factor	0.139
Rwork	0.137
R-free	0.16600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3cbx
RMSD bond length	0.016
RMSD bond angle	1.600
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.430
High resolution limit [Å]	1.380	1.380
Rmerge	0.046	0.397
Number of reflections	21576
<I/σ(I)>	32.1	2.8
Completeness [%]	99.3	94.6
Redundancy	5.5	4.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	292	0.1 M HEPES, 0.8 M sodium phosphate, 0.8 M Potassium phosphate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 292K