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4KCW

Pyruvate kinase (PYK) from Trypanosoma brucei soaked with oxalate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I24
Synchrotron siteDiamond
BeamlineI24
Temperature [K]100
Spacegroup nameI 2 2 2
Unit cell lengths103.880, 108.560, 264.530
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution68.440 - 2.500
R-factor0.16185
Rwork0.160
R-free0.20233
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.011
RMSD bond angle1.057
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]74.9502.640
High resolution limit [Å]2.5002.500
Number of reflections52143
Completeness [%]100.0100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.227715-20% PEG 8,000, 10-20% glycerol, 80 uM F26BP, 800 uM Ponceau S, 50 mM TEA, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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