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2XRU

AURORA-A T288E COMPLEXED WITH PHA-828300

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-2
Synchrotron siteESRF
BeamlineID14-2
Temperature [K]100
Detector technologyCCD
Collection date2003-09-17
DetectorADSC CCD
Spacegroup nameP 61 2 2
Unit cell lengths82.467, 82.467, 165.453
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution29.980 - 2.900
R-factor0.247
Rwork0.247
R-free0.34400
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.100
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0003.000
High resolution limit [Å]2.9002.900
Rmerge0.0500.750
Number of reflections7931
<I/σ(I)>34.63.2
Completeness [%]99.899.7
Redundancy10.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
15.615% PEG 5000 MME, 0.2 M LITHIUM SULFATE, 0.1 M SODIUM CITRATE PH 5.6 & 2 MM DTT

217705

數據於2024-03-27公開中

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