6UQJ

Crystal structure of the GH39 enzyme from Xanthomonas axonopodis pv. citri

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	LNLS BEAMLINE W01B-MX2
Synchrotron site	LNLS
Beamline	W01B-MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-02-21
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.459
Spacegroup name	C 1 2 1
Unit cell lengths	117.140, 57.097, 81.120
Unit cell angles	90.00, 107.53, 90.00

Refinement procedure

Resolution	28.930 - 1.707
R-factor	0.1641
Rwork	0.162
R-free	0.19710
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ekj
RMSD bond length	0.007
RMSD bond angle	1.168
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.8.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.670	1.768
High resolution limit [Å]	1.707	1.707
Number of reflections	54724	5211
<I/σ(I)>	20.09
Completeness [%]	98.2
Redundancy	6
CC(1/2)	0.999	0.848

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.1 M MIB Buffer pH 5.0 and 25% (w/v) PEG 1500