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3SAN

Crystal structure of influenza A virus neuraminidase N5 complexed with Zanamivir

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE AR-NE3A
Synchrotron sitePhoton Factory
BeamlineAR-NE3A
Temperature [K]100
Detector technologyCCD
Collection date2010-12-11
DetectorADSC QUANTUM 270
Wavelength(s)0.98
Spacegroup nameP 4
Unit cell lengths112.110, 112.110, 66.767
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution35.452 - 1.600
R-factor0.1223
Rwork0.120
R-free0.15720
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3nss
RMSD bond length0.005
RMSD bond angle1.040
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.5_2))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.660
High resolution limit [Å]1.6001.600
Number of reflections109012
Completeness [%]100.0100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52910.1M HEPES (pH 7.5), 12% w/v Polyethylene glycol 3350 , VAPOR DIFFUSION, HANGING DROP, temperature 291K

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