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Crystal structure of phosphoglycerate dehydrogenase from Pyrococcus horikoshii OT3

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B1
Synchrotron siteSPring-8
BeamlineBL26B1
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2004-12-13
DetectorRIGAKU RAXIS V
Wavelength(s)1.0000
Spacegroup nameC 1 2 1
Unit cell lengths222.417, 46.163, 66.258
Unit cell angles90.00, 92.53, 90.00
Refinement procedure
Resolution37.480 - 1.900
R-factor0.224
Rwork0.224
R-free0.24600
Structure solution methodMIR
RMSD bond length0.011
RMSD bond angle1.600
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareSOLVE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0001.970
High resolution limit [Å]1.9001.900
Rmerge0.0590.442
Number of reflections53427
<I/σ(I)>11.83.9
Completeness [%]100.0100
Redundancy4.14.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1MICROBATCH5.7295PEG4000, NAD, pH 5.7, microbatch, temperature 295K
1MICROBATCH5.7295PEG4000, NAD, pH 5.7, microbatch, temperature 295K
1MICROBATCH5.7295PEG4000, NAD, pH 5.7, microbatch, temperature 295K

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