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4UM8

Crystal structure of alpha V beta 6

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 23-ID-D
Synchrotron siteAPS
Beamline23-ID-D
Temperature [K]100
Detector technologyCCD
Collection date2012-07-15
DetectorMARRESEARCH
Spacegroup nameC 1 2 1
Unit cell lengths184.450, 170.010, 102.390
Unit cell angles90.00, 98.68, 90.00
Refinement procedure
Resolution48.656 - 2.852
R-factor0.2395
Rwork0.238
R-free0.28080
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4g1m
RMSD bond length0.004
RMSD bond angle0.718
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((PHENIX.REFINE))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.920
High resolution limit [Å]2.8502.850
Rmerge0.180
Number of reflections69912
<I/σ(I)>4.80.33
Completeness [%]97.491
Redundancy2.42.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1615% PEG 4000, 0.1 M NACACODYLATE, PH 6.0

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