7F0U

porcine epidemic diarrhea virus papain-like protease 2 C44S mutant in complex with mono ubiquitin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL13B1
Synchrotron site	NSRRC
Beamline	BL13B1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-03-20
Detector	ADSC QUANTUM 315
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	37.130, 86.451, 90.696
Unit cell angles	90.00, 91.79, 90.00

Refinement procedure

Resolution	29.180 - 2.200
R-factor	0.2271
Rwork	0.226
R-free	0.26040
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6noz
RMSD bond length	0.004
RMSD bond angle	1.316
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.280
High resolution limit [Å]	2.200	2.200
Rmerge	0.050	0.355
Rmeas	0.058	0.416
Rpim	0.030	0.215
Number of reflections	29253	2883
<I/σ(I)>	25.1	3.7
Completeness [%]	99.9	100
Redundancy	3.7	3.7
CC(1/2)		0.903

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	295	19% PEG-3350, 50 mM HEPES pH 8.0 and 1% w/v tryptone