6ZHM

Crystal Structure of Staphylococcus aureus RsgA bound to GDP.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-13
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.97949
Spacegroup name	P 21 21 21
Unit cell lengths	50.240, 66.970, 113.360
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	101.940 - 2.150
Rwork	0.240
R-free	0.27270
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6zhl
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	101.940	101.940	2.260
High resolution limit [Å]	2.150	6.790	2.150
Rmerge	0.259	0.096	2.128
Rmeas	0.282	0.104	2.320
Rpim	0.109	0.040	0.909
Total number of observations	239084	7770	33055
Number of reflections	37173	1257	5378
<I/σ(I)>	5.5	15.4	1
Completeness [%]	99.9	99.8	99.6
Redundancy	6.4	6.2	6.1
CC(1/2)	0.990	0.994	0.375

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	290	0.2 M Sodium Citrate, 0.1 M Bis-Tris Propane, 20% w/v PEG 3350