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7BSC

Complex structure of 1G5.3 Fab bound to DENV2 NS1c

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U1
Synchrotron siteSSRF
BeamlineBL17U1
Temperature [K]100
Detector technologyCCD
Collection date2018-03-16
DetectorADSC QUANTUM 315
Wavelength(s)0.97774
Spacegroup nameP 21 2 21
Unit cell lengths41.861, 80.980, 264.754
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution44.320 - 2.310
R-factor0.207
Rwork0.205
R-free0.23690
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4o6b
RMSD bond length0.004
RMSD bond angle0.683
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX (1.16_3549)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.380
High resolution limit [Å]2.3002.300
Number of reflections397473632
<I/σ(I)>14.7
Completeness [%]97.5
Redundancy12.7
CC(1/2)0.9900.992
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP72910.1 M DL-Malic acid pH 7.0, 12% w/v Polyethylene glycol 3350

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