6XXW

Structure of beta-D-Glucuronidase for Dictyoglomus thermophilum.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-06-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98
Spacegroup name	I 2 2 2
Unit cell lengths	79.130, 115.820, 130.540
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.834 - 1.851
R-factor	0.1622
Rwork	0.160
R-free	0.20690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1bhg
Data reduction software	XDS (20180808)
Data scaling software	XDS (20180808)
Phasing software	PHASER (2.8.2)
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	33.834	33.834	1.960
High resolution limit [Å]	1.850	5.520	1.850
Rmerge	0.111	0.030	0.743
Rmeas	0.125	0.034	0.837
Total number of observations	235094
Number of reflections	50245	1982	7994
<I/σ(I)>	12.15	35.43	2.46
Completeness [%]	97.7	94.4	97
Redundancy	4.679	4.483	4.531
CC(1/2)	0.997	0.999	0.709

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	298	20% w/v 2-Methylpentane-2,2-diol 100mM NaHEPES pH 7.5 100mM Citrate sodium