8SUA

Structure of M. baixiangningiae DarR-ligand complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-02-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	P 32 2 1
Unit cell lengths	85.437, 85.437, 62.436
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.720 - 1.600
R-factor	0.1853
Rwork	0.184
R-free	0.20900
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.150
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	AutoSol
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.720	1.640
High resolution limit [Å]	1.600	1.600
Rpim	0.020	0.406
Number of reflections	35029	2647
<I/σ(I)>	25.2	2.1
Completeness [%]	99.9
Redundancy	11.2
CC(1/2)	1.000	0.805

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		273	1.5 M NaCl, 0.2 M MgCl2, 0.1 M Tris