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1X9U

Umecyanin from Horse Raddish- Crystal Structure of the reduced form

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date2003-11-19
DetectorMARRESEARCH
Wavelength(s)1.542
Spacegroup nameP 65
Unit cell lengths92.650, 92.650, 47.700
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 1.800
R-factor0.199
Rwork0.199
R-free0.24400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1jer
RMSD bond length0.017
RMSD bond angle1.770
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0001.850
High resolution limit [Å]1.8001.800
Rmerge0.0770.445
Number of reflections21408
<I/σ(I)>27.53.2
Completeness [%]98.2100
Redundancy6.66.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5293PEG3350, Bicine, Magnesium chloride, pH 5.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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