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1VCE

Crystal structure of project ID PH0725 from Pyrococcus horikoshii OT3

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B1
Synchrotron siteSPring-8
BeamlineBL26B1
Temperature [K]100
Detector technologyCCD
Collection date2004-02-17
DetectorRIGAKU JUPITER
Wavelength(s)0.97938
Spacegroup nameP 41 21 2
Unit cell lengths104.721, 104.721, 138.672
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution39.210 - 2.100
R-factor0.218
Rwork0.218
R-free0.25300
Structure solution methodSAD
RMSD bond length0.006
RMSD bond angle1.300
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareSOLVE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0002.180
High resolution limit [Å]2.1002.100
Rmerge0.0610.540
Number of reflections45662
<I/σ(I)>13.33.85
Completeness [%]100.0100
Redundancy13.614
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1microbach5.52913.85M Na Formate, 0.1M Acetate, pH 5.5, microbach, temperature 291K

219869

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