7L1W

Unlocking the structural features for the exo-xylobiosidase activity of an unusual GH11 member identified in a compost-derived consortium

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	PIXEL
Collection date	2017-09-04
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.459
Spacegroup name	P 63
Unit cell lengths	96.950, 96.950, 40.899
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.990 - 1.710
R-factor	0.1609
Rwork	0.159
R-free	0.19210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5vqj
RMSD bond length	0.006
RMSD bond angle	0.856
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (Phenix.Refine)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.990	1.770
High resolution limit [Å]	1.710	1.710
Rmeas	0.116	1.956
Rpim	0.027	0.546
Number of reflections	23891	2358
<I/σ(I)>	19.92	1.52
Completeness [%]	99.9
Redundancy	18.1
CC(1/2)	0.999	0.668

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	291	0.1M MES pH 6.5 and 30% (w/v) PEG 4000