9RP8

Crystal structure of the T=1 icosahedral capsid of Turnip Crinkle Virus P38

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-20
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.9184
Spacegroup name	H 3
Unit cell lengths	203.383, 203.383, 469.128
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.810 - 2.890
R-factor	0.1986
Rwork	0.173
R-free	0.19320
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.653
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.060
High resolution limit [Å]	2.890	8.550	2.890
Rmerge	0.190
Rmeas	0.210
Number of reflections	162094	6239	26071
<I/σ(I)>	9.74
Completeness [%]	99.9		99.5
Redundancy	5.5
CC(1/2)	0.990	0.998	0.351

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.7	285	100 mM MES (sodium salt), 200 mM ammonium sulfate, 22% (w/v) PEG 8000