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2EEQ

Mutant Y29M structure of PH0725 from Pyrococcus horikoshii OT3

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2006-09-22
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 41 21 2
Unit cell lengths104.697, 104.697, 136.615
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution14.900 - 2.500
R-factor0.19
Rwork0.190
R-free0.23700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1wng
RMSD bond length0.009
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]15.0002.590
High resolution limit [Å]2.5002.500
Rmerge0.0960.438
Number of reflections26782
<I/σ(I)>9.24.9
Completeness [%]100.0100
Redundancy13.813.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Microbach6.52951.8M Ammonium Sulfate, 0.1M MES, 0.01M Co Chloride, 1mM DTT, pH 6.5, Microbach, temperature 295K

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