5ZQJ

Crystal structure of beta-xylosidase from Bacillus pumilus

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	PIXEL
Collection date	2016-11-04
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.99990
Spacegroup name	C 1 2 1
Unit cell lengths	115.261, 105.201, 105.814
Unit cell angles	90.00, 122.71, 90.00

Refinement procedure

Resolution	47.245 - 1.730
R-factor	0.1562
Rwork	0.154
R-free	0.18820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yif
RMSD bond length	0.007
RMSD bond angle	0.875
Data reduction software	DENZO
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.760
High resolution limit [Å]	1.730	1.730
Rmerge	0.080	0.294
Rmeas	0.088	0.347
Rpim	0.036	0.180
Number of reflections	107503	5058
<I/σ(I)>	17.23	2.63
Completeness [%]	97.5	92.1
Redundancy	4.7	3
CC(1/2)		0.785

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		287	0.05M HEPES (pH 7.5), 20%(w/v) PEG 3350, 1%(w/v) tryptone