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1OI6

Structure determination of the TMP-complex of EvaD

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-2
Synchrotron siteESRF
BeamlineID14-2
Temperature [K]100
Detector technologyCCD
Collection date2001-11-29
DetectorADSC CCD
Spacegroup nameP 21 21 2
Unit cell lengths98.500, 72.571, 57.239
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution34.100 - 1.400
R-factor0.13
Rwork0.129
R-free0.16600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ofn
RMSD bond length0.021
RMSD bond angle1.803
Data reduction softwareMOSFLM
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.1.19)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.1001.450
High resolution limit [Å]1.4001.400
Rmerge0.0740.450
Number of reflections80059
<I/σ(I)>6.31.5
Completeness [%]99.899.8
Redundancy44
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP825% PEG4K, 100MM MGCL2, 100MM TRIS-HCL, PH8.0, SITTING DROP, pH 8.00

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