3ETI

Structure of a cubic crystal form of X (ADRP) domain from FCoV

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-2
Synchrotron site	ESRF
Beamline	ID14-2
Temperature [K]	100
Detector technology	CCD
Collection date	2008-03-13
Detector	ADSC QUANTUM 4
Wavelength(s)	0.933
Spacegroup name	P 21 3
Unit cell lengths	218.990, 218.990, 218.990
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.800 - 2.200
R-factor	0.149
Rwork	0.147
R-free	0.18100
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.020
RMSD bond angle	1.624
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.330
High resolution limit [Å]	2.200	2.200
Rmerge	0.154	0.607
Number of reflections	176075	28013
<I/σ(I)>	20.33	5.6
Completeness [%]	99.8	98.9
Redundancy	21.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	292	ammonium citrate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 292K