8TWS

AvrB bound with UDP-rhamnose and RIN4 C-NOI motif

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 2.0.1
Synchrotron site	ALS
Beamline	2.0.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-06-09
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.0358
Spacegroup name	P 21 21 2
Unit cell lengths	58.622, 123.580, 45.552
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	52.970 - 2.850
R-factor	0.2853
Rwork	0.280
R-free	0.33550
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.764
Data reduction software	xia2
Data scaling software	DIALS
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.970	2.900
High resolution limit [Å]	2.850	2.850
Number of reflections	8193	375
<I/σ(I)>	2
Completeness [%]	99.9
Redundancy	6
CC(1/2)	0.925	0.038

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	100 mM Tris (pH 7.5~7.8), 27%~32% PEG 550 MME