3KZ4

Crystal Structure of the Rotavirus Double Layered Particle

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE F1
Synchrotron site	CHESS
Beamline	F1
Temperature [K]	100
Detector technology	CCD
Detector	ADSC QUANTUM 4
Spacegroup name	P 21 21 21
Unit cell lengths	740.750, 1198.070, 1345.410
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 3.800
Rwork	0.328
R-free	0.33900
Structure solution method	Molecular Replacement from EM model
RMSD bond length	0.011
RMSD bond angle	1.667
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CCP4
Refinement software	CNS

Data quality characteristics

	Overall
Low resolution limit [Å]	223.000
High resolution limit [Å]	3.800
Rmerge	0.182
Number of reflections	1823596
<I/σ(I)>	3.4
Completeness [%]	20.8
Redundancy	1.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	295	50 mM NaCl, 375 mM Sodium Sulfate, 1.6% PEG 10,000, 0.02% Sodium Azide, 20 mM HEPES pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K