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4DDN

Structure analysis of a wound-inducible lectin ipomoelin from sweet potato

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSRRC BEAMLINE BL13C1
Synchrotron siteNSRRC
BeamlineBL13C1
Temperature [K]100
Detector technologyCCD
Collection date2011-07-11
DetectorADSC QUANTUM 210
Wavelength(s)0.97622
Spacegroup nameP 21 21 21
Unit cell lengths82.075, 83.931, 86.129
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution26.080 - 1.900
R-factor0.186
Rwork0.186
R-free0.22800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3r50
RMSD bond length0.016
RMSD bond angle1.900
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.970
High resolution limit [Å]1.9001.900
Rmerge0.0730.303
Number of reflections47849
<I/σ(I)>29.97.6
Completeness [%]100.0100
Redundancy7.37.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7298A drop containing 0.2 M sodium formate, 20% w/v Polyethylene glycol 3,350 against a reservoir of 0.4 M sodium formate, 40% w/v Polyethylene glycol 3,350, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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