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2OBT

Crystal Structures of P Domain of Norovirus VA387 in Complex with Blood Group Trisaccharides type B

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2006-08-20
DetectorMAR scanner 345 mm plate
Wavelength(s)1.5418
Spacegroup nameC 2 2 21
Unit cell lengths55.999, 95.194, 118.657
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 2.000
R-factor0.217
Rwork0.214
R-free0.25700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2obr
RMSD bond length1.454
RMSD bond angle0.007
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.100
High resolution limit [Å]2.0002.000
Rmerge0.0680.263
Number of reflections20238
<I/σ(I)>17.95.1
Completeness [%]97.097
Redundancy9.55.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP82910.2M MgAc, 8% PEG3350, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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