6E48

Crystal Structure of the Murine Norovirus VP1 P domain in complex with the CD300lf Receptor and Lithocholic Acid

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2017-10-02
Detector	NOIR-1
Wavelength(s)	1.00004
Spacegroup name	P 21 21 2
Unit cell lengths	101.091, 152.891, 70.037
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	63.674 - 1.801
R-factor	0.1751
Rwork	0.174
R-free	0.20390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 3LQ6 & 5FFL
RMSD bond length	0.022
RMSD bond angle	1.109
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	63.680	1.870
High resolution limit [Å]	1.800	1.800
Number of reflections	95932	11228
<I/σ(I)>	5.92	0.65
Completeness [%]	95.0	63
Redundancy	2	1.8
CC(1/2)	0.996	0.324

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.7	293	0.1 M Tris, pH 8.7, 40 mM calcium chloride, 5.5% PEG10000