6ZT8

X-ray structure of mutated arabinofuranosidase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX II BEAMLINE I911-3
Synchrotron site	MAX II
Beamline	I911-3
Temperature [K]	100
Detector technology	CCD
Collection date	2014-05-27
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.999
Spacegroup name	P 65 2 2
Unit cell lengths	156.630, 156.630, 376.320
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.000 - 2.800
R-factor	0.2094
Rwork	0.209
R-free	0.24660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2vrq
RMSD bond length	0.009
RMSD bond angle	1.310
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	2.870
High resolution limit [Å]	2.800	2.800
Number of reflections	67863	4885
<I/σ(I)>	7.44
Completeness [%]	99.9
Redundancy	11.27
CC(1/2)	0.986	0.226

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	0.2 M MgCl2, 0.1 M HEPES pH 7.5, 34% (v/v) PEG400