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2D3Z

X-ray crystal structure of hepatitis C virus RNA-dependent RNA polymerase in complex with non-nucleoside analogue inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU300
Temperature [K]105
Detector technologyIMAGE PLATE
Collection date2004-06-10
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths84.755, 106.127, 127.444
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution33.110 - 1.800
R-factor0.199
Rwork0.199
R-free0.23200
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.005
RMSD bond angle1.200
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]33.1101.860
High resolution limit [Å]1.8001.800
Number of reflections95800
Completeness [%]89.692.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP529820mg/ml protein in 5mM 2-mercaptoethanol, 18% PEG 4000, 0.3M NaCl, 0.1M sodium acetate buffer, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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