7AVK

Streptococcal High Identity Repeats in Tandem (SHIRT) domain 10 from cell surface protein SGO_0707

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	2018-10-18
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.78001
Spacegroup name	P 21 21 2
Unit cell lengths	65.380, 47.990, 48.380
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.380 - 0.820
R-factor	0.147
Rwork	0.147
R-free	0.16260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	SHIRT R2
RMSD bond length	0.017
RMSD bond angle	1.491
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.17.1_3660))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.380	0.849
High resolution limit [Å]	0.820	0.820
Rmerge	0.045	2.057
Rmeas		2.909
Number of reflections	147184	24481
<I/σ(I)>	28.26	0.34
Completeness [%]	96.8	76.5
Redundancy	2	1.9
CC(1/2)	1.000	0.239

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	277	2.2 M ammonium sulphate, 150 mM potassium thiocyanate