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4B8J

rImp_alpha1a

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron siteAustralian Synchrotron
BeamlineMX2
Temperature [K]100
Detector technologyCCD
Collection date2011-08-20
DetectorADSC QUANTUM 315r
Spacegroup nameC 1 2 1
Unit cell lengths134.252, 72.736, 62.425
Unit cell angles90.00, 91.18, 90.00
Refinement procedure
Resolution19.841 - 2.001
R-factor0.1496
Rwork0.148
R-free0.17780
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ee4
RMSD bond length0.010
RMSD bond angle1.180
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwarePHENIX ((PHENIX.REFINE))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.8402.110
High resolution limit [Å]2.0002.000
Rmerge0.0500.220
Number of reflections40273
<I/σ(I)>16.25.4
Completeness [%]99.195.7
Redundancy3.73.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
170.1 M BIS-TRIS PROPANE PH 7.0, 15-17% PEG 3350, 0.2 M NAF, 0.2 M NDSB-221.

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