2DS5

Structure of the ZBD in the orthorhomibic crystal from

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2004-05-30
Detector	ADSC QUANTUM 210
Wavelength(s)	1.00000
Spacegroup name	P 21 21 21
Unit cell lengths	32.523, 43.399, 67.719
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 1.500
R-factor	0.189
Rwork	0.185
R-free	0.22100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ds8
RMSD bond length	0.009
RMSD bond angle	1.323
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.550
High resolution limit [Å]	1.500	1.500
Number of reflections	13866
Completeness [%]	86.8	45.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	295	100mM Hepes-NaOH, pH 7.5, 200mM calcium chloride, 30% PEG400, VAPOR DIFFUSION, HANGING DROP, temperature 295K