4R27

Crystal structure of beta-glycosidase BGL167

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-04-21
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9795
Spacegroup name	P 1 21 1
Unit cell lengths	48.498, 146.940, 53.041
Unit cell angles	90.00, 101.99, 90.00

Refinement procedure

Resolution	23.200 - 2.030
R-factor	0.19328
Rwork	0.191
R-free	0.23932
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3cmj
RMSD bond length	0.017
RMSD bond angle	1.849
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.070
High resolution limit [Å]	2.030	2.030
Number of reflections	44261
Completeness [%]	97.2	98.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.5	291	36% MPD-PEG 1000-PEG 3350 mixture, 55mM calcium chloride, pH 7.5, VAPOR DIFFUSION, temperature 291K