10OS

Structure of the apo form of the Roseobacterial MED193 sp. GapR protein

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	2020-03-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0
Spacegroup name	P 41 21 2
Unit cell lengths	57.193, 57.193, 169.482
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.340 - 2.980
R-factor	0.2318
Rwork	0.227
R-free	0.27310
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.910
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.340	3.280
High resolution limit [Å]	2.940	2.940
Rmerge	0.045	1.016
Rpim	0.021	0.597
Number of reflections	6238	1347
<I/σ(I)>	22.7	1.9
Completeness [%]	98.1
Redundancy	9.3
CC(1/2)	0.998	0.886

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M 4-(2-hydroxyethyl)piperazin-1-yl]ethanesulfonic acid (HEPES) pH 7.5 and 25% (w/v) PEG 6000