5XJP

Crystal structure of response regulator AdeR receiver domain with Mg

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98
Spacegroup name	P 32 2 1
Unit cell lengths	64.753, 64.753, 49.962
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.039 - 1.597
R-factor	0.1789
Rwork	0.176
R-free	0.20740
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5x5j
RMSD bond length	0.008
RMSD bond angle	1.058
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	PHENIX ((1.11.1_2575))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.040	1.650
High resolution limit [Å]	1.597	1.600
Rmerge	0.045
Number of reflections	16262
<I/σ(I)>	36.84
Completeness [%]	99.1
Redundancy	18.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	2.8 M Sodium acetate trihydrate pH 7.0