9U8H

Crystal structure of Leminorella grimontii GatC in the absence of D-xylose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-02-03
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.0
Spacegroup name	P 2 21 21
Unit cell lengths	87.870, 100.840, 122.880
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.650 - 3.740
R-factor	0.2568
Rwork	0.254
R-free	0.28550
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.635
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.650	3.910
High resolution limit [Å]	3.740	3.740
Number of reflections	11682	2801
<I/σ(I)>	3.03
Completeness [%]	99.1
Redundancy	41.6
CC(1/2)	0.859	0.281

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	8	293.15	100 mM Na-acetate, 100 mM Tris-HCl (pH8.0), 40-45% PEG200