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2H07

crystal structure of human phosphoribosyl pyrophosphate synthetase 1 mutant S132A

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2005-06-28
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameH 3
Unit cell lengths170.339, 170.339, 61.720
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 2.200
R-factor0.218
Rwork0.218
R-free0.25400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2h06
RMSD bond length0.006
RMSD bond angle1.200
Data reduction softwareCrystalClear ((MSC/RIGAKU))
Data scaling softwared*TREK
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0002.280
High resolution limit [Å]2.2002.200
Rmerge0.067
Number of reflections33483
<I/σ(I)>8.6
Completeness [%]98.897.7
Redundancy4.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.32930.1M citric acid, 1.3M ammonium sulfate, 0.02M sodium dihydrogen phosphate, 0.4M sodium chloride, pH 4.3, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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