6D41

Bacteriodes uniformis beta-glucuronidase 1 bound to D-glucaro-1,5-lactone

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-16
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.03322
Spacegroup name	C 1 2 1
Unit cell lengths	126.066, 130.156, 94.490
Unit cell angles	90.00, 100.24, 90.00

Refinement procedure

Resolution	29.934 - 1.900
R-factor	0.1404
Rwork	0.140
R-free	0.16860
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6d1n
RMSD bond length	0.007
RMSD bond angle	0.855
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.934	1.930
High resolution limit [Å]	1.900	1.900
Number of reflections	114979
<I/σ(I)>	16.6
Completeness [%]	97.7
Redundancy	6.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	16% PEG 1000, Tris pH 8.5, 2mM Saccharolactone