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1ROA

Structure of human cystatin D

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsMAX II BEAMLINE I711
Synchrotron siteMAX II
BeamlineI711
Temperature [K]100
Detector technologyCCD
Collection date2000-03-22
DetectorMARRESEARCH
Wavelength(s)0.9979
Spacegroup nameP 21 21 2
Unit cell lengths34.050, 81.720, 46.740
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution16.000 - 1.800
R-factor0.25
Rwork0.250
R-free0.27800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1cew
RMSD bond length0.005
RMSD bond angle1.300
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]16.0001.860
High resolution limit [Å]1.8001.800
Rmerge0.0580.342
Number of reflections12036
Completeness [%]94.998.1
Redundancy2.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5291Tris-HCl, PEG400, (NH4)2SO4, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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