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4GTL

T. Maritima FDTS (R174K mutant) with FAD

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL9-2
Synchrotron siteSSRL
BeamlineBL9-2
Temperature [K]100
Detector technologyCCD
Collection date2004-06-18
DetectorADSC QUANTUM 315
Wavelength(s)0.9794
Spacegroup nameP 21 21 21
Unit cell lengths53.780, 116.460, 141.190
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution38.050 - 2.170
R-factor0.19198
Rwork0.189
R-free0.24073
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1o26
RMSD bond length0.015
RMSD bond angle1.725
Data reduction softwareXDS
Data scaling softwareXDS
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0002.230
High resolution limit [Å]2.1702.170
Rmerge0.065
Number of reflections47764
<I/σ(I)>18.11.9
Completeness [%]99.899.5
Redundancy54.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP829550-60% PEG 200 and 100mM Tris HCL (pH 8.0), VAPOR DIFFUSION, HANGING DROP, temperature 295K

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