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2XEC

Nocardia farcinica maleate cis-trans isomerase bound to TRIS

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID23-1
Synchrotron siteESRF
BeamlineID23-1
Temperature [K]100
Detector technologyCCD
Collection date2009-04-18
DetectorADSC CCD
Spacegroup nameP 21 21 21
Unit cell lengths50.160, 84.510, 238.130
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.670 - 2.200
R-factor0.24112
Rwork0.239
R-free0.28841
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3dg9
RMSD bond length0.017
RMSD bond angle1.697
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.1602.320
High resolution limit [Å]2.2002.200
Rmerge0.0800.460
Number of reflections52302
<I/σ(I)>9.62.6
Completeness [%]99.699.9
Redundancy4.34.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.5300 MM CA ACETATE 100 MM TRIS PH 7.5 5 MM NA MALEATE 16% PEG 3350

219869

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