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9DF5

Human norovirus GII.3 protease

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.2.2
Synchrotron siteALS
Beamline8.2.2
Temperature [K]100
Detector technologyPIXEL
Collection date2023-03-29
DetectorDECTRIS PILATUS3 S 2M
Wavelength(s)1.00002
Spacegroup nameP 43 21 2
Unit cell lengths78.525, 78.525, 105.686
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution63.030 - 2.800
R-factor0.2539
Rwork0.252
R-free0.29650
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.003
RMSD bond angle0.572
Data reduction softwarexia2
Data scaling softwarexia2
Phasing softwarePHASER
Refinement softwarePHENIX (1.21rc1_5156)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]63.0302.850
High resolution limit [Å]2.8002.800
Rmerge0.0810.504
Rmeas0.0850.528
Rpim0.0280.157
Number of reflections8595415
<I/σ(I)>18.32.1
Completeness [%]99.8100
Redundancy10.511.2
CC(1/2)0.9980.915
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.52980.1-0.35M KSCN, 15-25% PEG 3,350, 0.1M Bis-Tris Propane

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