6EFF

NCTC10712

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2017-12-15
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.979
Spacegroup name	P 1
Unit cell lengths	39.786, 48.268, 99.823
Unit cell angles	101.84, 91.39, 89.90

Refinement procedure

Resolution	47.241 - 1.600
R-factor	0.1817
Rwork	0.180
R-free	0.20780
RMSD bond length	0.006
RMSD bond angle	0.924
Refinement software	PHENIX ((1.12_2829))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.640
High resolution limit [Å]	1.600	1.600
Number of reflections	96441
<I/σ(I)>	22.9
Completeness [%]	92.4
Redundancy	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1 M Tris pH 7.5, 32% w/v PEG 4000