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6ABZ

Crystal Structure of HEWL in deionized water

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALBA BEAMLINE XALOC
Synchrotron siteALBA
BeamlineXALOC
Temperature [K]100
Detector technologyPIXEL
Collection date2017-11-01
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9792
Spacegroup nameP 43 21 2
Unit cell lengths78.139, 78.139, 37.140
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution55.250 - 1.700
R-factor0.17433
Rwork0.171
R-free0.23415
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1dpx
RMSD bond length0.020
RMSD bond angle1.895
Data reduction softwareiMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0135)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]55.2501.790
High resolution limit [Å]1.7001.700
Rmerge0.200
Number of reflections13065
<I/σ(I)>9.2
Completeness [%]99.3
Redundancy10.14
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.62920.1 M sodium acetate pH 4.6 and 2 M NaCl

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