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2C88

Crystal Structure Of (SR) Calcium-ATPase E2(Tg):AMPPCP form

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsEMBL/DESY, HAMBURG BEAMLINE X11
Synchrotron siteEMBL/DESY, HAMBURG
BeamlineX11
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2004-03-27
DetectorMARRESEACH
Spacegroup nameP 41 21 2
Unit cell lengths71.529, 71.529, 590.216
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution14.990 - 3.100
R-factor0.261
Rwork0.261
R-free0.31000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1iwo
RMSD bond length0.010
RMSD bond angle1.500
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]100.0003.170
High resolution limit [Å]3.1003.100
Rmerge0.1200.600
Number of reflections29134
<I/σ(I)>19.63.7
Completeness [%]99.699.8
Redundancy7.87.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.850 MM SODIUM ACETATE, 15 % PEG 2000 MME, 10 % GLYCEROL, 4 % MPD, pH 6.80

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