6IVD

TGEV nsp1 mutant - 91-95sg

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-05-23
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97918
Spacegroup name	P 1 21 1
Unit cell lengths	33.442, 59.242, 57.175
Unit cell angles	90.00, 97.54, 90.00

Refinement procedure

Resolution	40.955 - 1.975
R-factor	0.1937
Rwork	0.191
R-free	0.23710
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.955	2.127
High resolution limit [Å]	1.975	1.975
Number of reflections	15284
<I/σ(I)>	26.22
Completeness [%]	97.6
Redundancy	2.68

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG 3350, Ammonium phosphate dibasic