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2WS2

The 2 Angstrom structure of a Nu-class GST from Haemonchus contortus

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsMPG/DESY, HAMBURG BEAMLINE BW6
Synchrotron siteMPG/DESY, HAMBURG
BeamlineBW6
Temperature [K]100
Detector technologyCCD
Collection date2004-03-29
DetectorMARRESEARCH
Spacegroup nameP 1 21 1
Unit cell lengths47.216, 101.382, 47.170
Unit cell angles90.00, 100.46, 90.00
Refinement procedure
Resolution50.710 - 2.010
R-factor0.23591
Rwork0.233
R-free0.28983
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1tw9
RMSD bond length0.017
RMSD bond angle1.891
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0088)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]14.0002.030
High resolution limit [Å]2.0102.000
Rmerge0.1200.510
Number of reflections28361
<I/σ(I)>124.392.44
Completeness [%]97.797.2
Redundancy4.694.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1100MM TRIS HCL, PH 8.5, 50 MM CACL2, 30% (W/V) PEG 10000

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