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4YWI

F96S/L167V Double mutant of Plasmodium Falciparum Triosephosphate Isomerase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU ULTRAX 18
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2010-06-30
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54
Spacegroup nameP 21 2 21
Unit cell lengths50.933, 53.809, 174.495
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution33.890 - 1.850
R-factor0.16383
Rwork0.162
R-free0.20294
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1m7p
RMSD bond length0.008
RMSD bond angle1.248
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0049)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.9301.940
High resolution limit [Å]1.8501.850
Rmerge0.0760.180
Number of reflections35109
<I/σ(I)>3812.8
Completeness [%]83.661.4
Redundancy2.32.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5293PEG 1450 22%, HEPES, Li2SO4 10mM, DTT 0.5mM, NaN3 0.5mM, EDTA 0.5mM

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