6JYT

Delicate structural coordination of the Severe Acute Respiratory Syndrome coronavirus Nsp13 upon ATP hydrolysis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2015-03-21
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9785
Spacegroup name	C 1 2 1
Unit cell lengths	191.990, 189.150, 57.330
Unit cell angles	90.00, 102.89, 90.00

Refinement procedure

Resolution	48.833 - 2.800
R-factor	0.2403
Rwork	0.237
R-free	0.29250
Structure solution method	SAD
Data reduction software	XDS
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.720
High resolution limit [Å]	2.690	2.690
Rmerge	0.140
Number of reflections	48632	1065
<I/σ(I)>	10.6
Completeness [%]	100.0
Redundancy	10.58
CC(1/2)	0.990	0.790

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	289	12% w/v polyethylene glycol 20000, 2M ammonium sulfate, 0.1M MES monohydrate pH 6.5