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3C39

Crystal Structure of human phosphoglycerate kinase bound to 3-phosphoglycerate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyCCD
Collection date2007-03-27
DetectorADSC QUANTUM 315
Wavelength(s)0.933
Spacegroup nameP 1
Unit cell lengths35.616, 55.790, 93.230
Unit cell angles79.18, 84.33, 83.23
Refinement procedure
Resolution50.100 - 1.850
R-factor0.19383
Rwork0.191
R-free0.27281
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1vjc
RMSD bond length0.021
RMSD bond angle1.905
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.4.0062)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]91.2901.950
High resolution limit [Å]1.8501.850
Rmerge0.0480.340
Number of reflections44499
<I/σ(I)>141.9
Completeness [%]77.150.4
Redundancy1.91.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.32912.6M NaKPO4, pH 8.3, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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