3WOK

Crystal structure of the DAP BII (Space)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL41XU
Synchrotron site	SPring-8
Beamline	BL41XU
Temperature [K]	95
Detector technology	CCD
Collection date	2011-10-27
Detector	RAYONIX MX225HE
Wavelength(s)	0.80000
Spacegroup name	P 21 21 21
Unit cell lengths	76.740, 130.440, 171.460
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.560 - 1.950
R-factor	0.18396
Rwork	0.182
R-free	0.22531
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3woi
RMSD bond length	0.018
RMSD bond angle	1.889
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall
Low resolution limit [Å]	30.000
High resolution limit [Å]	1.950
Number of reflections	117965
Completeness [%]	99.0

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	COUNTER-DIFFUSION	9.5	293	18% PEG8000, 20% Glycerol, 2mM ZnCl2, 80mM CHES, pH 9.5, Counter-diffusion, temperature 293K