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2DUQ

Crystal structure of VIP36 exoplasmic/lumenal domain, Ca2+/Man-bound form

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]95
Detector technologyCCD
Collection date2005-11-24
DetectorADSC QUANTUM 315
Wavelength(s)1.0000
Spacegroup nameC 1 2 1
Unit cell lengths171.200, 45.000, 117.000
Unit cell angles90.00, 131.90, 90.00
Refinement procedure
Resolution20.000 - 1.800
R-factor0.208
Rwork0.206
R-free0.24500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2duo
RMSD bond length0.011
RMSD bond angle1.334
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.860
High resolution limit [Å]1.8001.800
Rmerge0.0990.282
Number of reflections59750
<I/σ(I)>9.12.9
Completeness [%]96.184.5
Redundancy3.22.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP & SOAKING6.527715% PEG4000, 1.5M NaCl, 0.1M MES (pH6.5), 50mM mannose, VAPOR DIFFUSION, HANGING DROP & SOAKING, temperature 277K

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