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4ANO

Crystal Structure Geobacillus thermodenitrificans EssB cytoplasmic fragment

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]293
Detector technologyCCD
Collection date2010-02-13
DetectorADSC QUANTUM 315r
Spacegroup nameP 41 21 2
Unit cell lengths74.622, 74.622, 83.545
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution44.610 - 1.700
R-factor0.20777
Rwork0.205
R-free0.25262
Structure solution methodSAD
Starting model (for MR)NONE
RMSD bond length0.023
RMSD bond angle2.009
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]44.6101.790
High resolution limit [Å]1.7001.700
Rmerge0.0500.460
Number of reflections26751
<I/σ(I)>24.44.3
Completeness [%]100.0100
Redundancy9.67.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
15.50.1 M TRI-SODIUM CITRATE PH5.5, 20% PEG3000, 0.25MM TRIS(2-CARBOXYETHYL)PHOSPHINE HYDROCHLORIDE

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