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1KA0

The PAPase Hal2p complexed with a sodium ion and the reaction product AMP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1999-08-05
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths54.600, 45.110, 71.600
Unit cell angles90.00, 111.36, 90.00
Refinement procedure
Resolution24.000 - 1.800
R-factor0.14951
Rwork0.147
R-free0.19539
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1qgx
Data reduction softwareX-GEN
Data scaling softwareCCP4 ((SCALA))
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]24.0001.846
High resolution limit [Å]1.8001.800
Rmerge0.0700.370
Number of reflections26475
<I/σ(I)>20.73.6
Completeness [%]87.287.5
Redundancy3.23.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.529330% PEG5000 MME, 0.1 M sodium acetate, 5 mM beta-mercaptoethanol, 0.1 M MES. (Crystals were soaked in mother liquor containing 0.5 M sodium chloride for 1 hour.) , pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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