7KGZ

FMN-binding beta-glucuronidase from Roseburia hominis

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	2019-07-26
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0330
Spacegroup name	P 1 21 1
Unit cell lengths	54.354, 161.142, 86.947
Unit cell angles	90.00, 107.33, 90.00

Refinement procedure

Resolution	39.070 - 2.400
R-factor	0.1428
Rwork	0.141
R-free	0.19520
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6mvh
RMSD bond length	0.007
RMSD bond angle	0.878
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.070	2.486
High resolution limit [Å]	2.400	2.400
Rmerge	0.050	0.124
Rmeas	0.060	0.147
Rpim	0.032	0.078
Number of reflections	55112	5470
<I/σ(I)>	18.68	8.37
Completeness [%]	98.9	98.38
Redundancy	3.5	3.5
CC(1/2)	0.997	0.981

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	12.5 mg/mL protein, 0.2 M lithium chloride, 20% (w/v) PEG 3350