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7V2Z

ZIKV NS3helicase in complex with ssRNA and ATP-Mn2+

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL18U1
Synchrotron siteSSRF
BeamlineBL18U1
Temperature [K]100
Detector technologyPIXEL
Collection date2016-09-20
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.97853
Spacegroup nameP 1 21 1
Unit cell lengths52.620, 72.356, 59.507
Unit cell angles90.00, 94.15, 90.00
Refinement procedure
Resolution40.810 - 2.101
R-factor0.191042529433
Rwork0.189
R-free0.23934
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5jmt
RMSD bond length0.007
RMSD bond angle0.877
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX (1.12_2829)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]45.8902.140
High resolution limit [Å]2.1002.100
Rmerge0.0540.443
Number of reflections257851307
<I/σ(I)>2.72
Completeness [%]97.6
Redundancy6.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2910.2 M potassium sodium tartrate tetrahydrate pH 7.4 and 20% (w/v) polyethylene glycol 3350

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