3GZF

Structure of the C-terminal domain of nsp4 from Feline Coronavirus

Experimental procedure

Experimental method	SAD
Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE X12
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	X12
Temperature [K]	100
Detector technology	CCD
Collection date	2008-12-12
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9777
Spacegroup name	P 43
Unit cell lengths	127.538, 127.538, 42.797
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.950 - 2.756
R-factor	0.243
Rwork	0.240
R-free	0.30000
Structure solution method	SAD
RMSD bond length	0.012
RMSD bond angle	1.613
Data reduction software	XDS
Data scaling software	SCALA (3.2.25)
Phasing software	BP3
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.920
High resolution limit [Å]	2.700	2.750
Rmerge	0.053	0.441
Number of reflections	18188
<I/σ(I)>	23.25	3.68
Completeness [%]	99.1	96.6
Redundancy	6.05	6.36

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		292	PEG 5000, ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 292K
1	VAPOR DIFFUSION, HANGING DROP		292	PEG 5000, ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 292K
1	VAPOR DIFFUSION, HANGING DROP		292	PEG 5000, ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 292K