6ZTA

X-ray structure of mutated arabinofuranosidase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-02-04
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976
Spacegroup name	P 65 2 2
Unit cell lengths	156.490, 156.490, 376.570
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.010 - 3.100
R-factor	0.3452
Rwork	0.345
R-free	0.37490
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2vrq
RMSD bond length	0.006
RMSD bond angle	1.025
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0230)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.180
High resolution limit [Å]	3.100	3.100
Number of reflections	50293	3668
<I/σ(I)>	4.81
Completeness [%]	99.9
Redundancy	26.55
CC(1/2)	0.985	0.501

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.9	298	0.2 M sodium thiocyanate pH 6.9, 20% (v/v) PEG3350