6S5Z

Structure of Rib R28N from Streptococcus pyogenes

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-12-03
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9202
Spacegroup name	P 1 21 1
Unit cell lengths	45.423, 43.560, 47.615
Unit cell angles	90.00, 118.27, 90.00

Refinement procedure

Resolution	41.940 - 1.800
R-factor	0.1727
Rwork	0.170
R-free	0.22420
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.940	1.864
High resolution limit [Å]	1.800	1.800
Rmerge	0.130	0.940
Number of reflections	15119	1482
<I/σ(I)>	8.1	1.85
Completeness [%]	98.8	97.8
Redundancy	4	4.1
CC(1/2)	1.000	0.640

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		279	0.15 M NaBr, 30% PEG 2K MME