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2HU0

N1 neuraminidase in complex with oseltamivir 1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2006-03-03
DetectorRIGAKU RAXIS IV
Wavelength(s)1.54
Spacegroup nameC 2 2 21
Unit cell lengths198.083, 200.576, 210.417
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution142.860 - 2.950
R-factor0.22136
Rwork0.218
R-free0.29530
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.023
RMSD bond angle2.283
Data reduction softwareCrystalClear ((MSC/RIGAKU))
Data scaling softwareCrystalClear ((MSC/RIGAKU))
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 Overall
Low resolution limit [Å]30.000
High resolution limit [Å]2.950
Number of reflections70678
Completeness [%]79.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8293MES, PEG3350, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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