7FAV

Crystal Structure of Rubella Protease

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2021-03-12
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.28482
Spacegroup name	P 43 21 2
Unit cell lengths	60.243, 60.243, 173.860
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.370 - 1.640
Rwork	0.180
R-free	0.19880
Structure solution method	SAD
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	CRANK2
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.370	1.670
High resolution limit [Å]	1.640	1.640
Rmerge	0.086	1.090
Rmeas	0.087
Rpim	0.012	0.152
Number of reflections	40150	3811
<I/σ(I)>	41.82
Completeness [%]	99.7	96.87
Redundancy	51	49.8
CC(1/2)	1.000	0.912

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	291.15	0.1M Hepes pH 7.5, 12.5% Peg 3350