3TA9

beta-Glucosidase A from the halothermophile H. orenii

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	2011-03-29
Detector	ADSC QUANTUM 315
Wavelength(s)	0.95375
Spacegroup name	P 21 21 21
Unit cell lengths	88.504, 99.577, 109.427
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.894 - 3.000
R-factor	0.1948
Rwork	0.191
R-free	0.26620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3FJ0
RMSD bond length	0.008
RMSD bond angle	1.230
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.6.4_486))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	74.000	3.160
High resolution limit [Å]	3.000	3.000
Number of reflections	19515
Completeness [%]	98.4	96
Redundancy	7.9	6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	0.2 M magnesium acetate, 20% PEG8000, 0.1 M sodium cacodylate, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K