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2VFD

Crystal structure of the F96S mutant of Plasmodium falciparum triosephosphate isomerase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44XU
Synchrotron siteSPring-8
BeamlineBL44XU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2006-03-20
DetectorDIP-2040B
Spacegroup nameP 1 21 1
Unit cell lengths53.423, 50.698, 89.188
Unit cell angles90.00, 92.17, 90.00
Refinement procedure
Resolution36.760 - 1.400
R-factor0.16628
Rwork0.165
R-free0.18828
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1o5x
RMSD bond length0.007
RMSD bond angle1.088
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCCP4
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.450
High resolution limit [Å]1.4001.400
Rmerge0.0500.240
Number of reflections90838
<I/σ(I)>40.57
Completeness [%]96.393.9
Redundancy3.33.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
150.1 M SODIUM ACETATE PH 4.0-5.5, PEG 1450 8-24%

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