5WUG

Expression, characterization and crystal structure of a novel beta-glucosidase from Paenibacillus barengoltzii

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	CMOS
Collection date	2015-12-25
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9777
Spacegroup name	P 21 21 21
Unit cell lengths	67.219, 75.786, 161.994
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.724 - 2.216
R-factor	0.1595
Rwork	0.157
R-free	0.20360
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2x40
RMSD bond length	0.007
RMSD bond angle	0.829
Data scaling software	HKL-2000
Refinement software	PHENIX ((dev_2474: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.216
Rmerge	0.101
Number of reflections	41633
<I/σ(I)>	6.1
Completeness [%]	99.0
Redundancy	6.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	25% PEG 3350, 0.1M Bis-Tris pH 6.5, 0.2M Ammonium acetate