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7OJ4

Crystal structure of apo NS3 helicase from tick-borne encephalitis virus

Replaces:  7AY4
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyPIXEL
Collection date2020-07-10
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.918400
Spacegroup nameP 41 21 2
Unit cell lengths73.298, 73.298, 196.048
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution49.060 - 1.828
Rwork0.181
R-free0.22910
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6adw
RMSD bond length0.016
RMSD bond angle1.934
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]49.0601.940
High resolution limit [Å]1.8281.830
Number of reflections482057581
<I/σ(I)>2.22
Completeness [%]99.999.3
Redundancy20
CC(1/2)1.0000.865
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2930.1 M Bis Tris Propane pH 6.5, 0.2 M Sodium acetate trihydrate, 20% w/v PEG 3350, 10% v/v Ethylene glycol

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