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3NBD

Clitocybe nebularis ricin B-like lectin (CNL) in complex with lactose, crystallized at pH 7.1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsELETTRA BEAMLINE 5.2R
Synchrotron siteELETTRA
Beamline5.2R
Temperature [K]100
Detector technologyCCD
Collection date2009-02-18
DetectorMAR CCD 165 mm
Wavelength(s)1.033
Spacegroup nameP 21 21 21
Unit cell lengths43.119, 85.080, 97.629
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution23.030 - 1.150
R-factor0.139
Rwork0.138
R-free0.16000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3nbc
RMSD bond length0.050
RMSD bond angle2.231
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]23.0301.160
High resolution limit [Å]1.1401.140
Rmerge0.0600.326
Number of reflections128514
<I/σ(I)>11.5
Completeness [%]98.365.6
Redundancy8.55
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.12930.085M HEPES sodium, 1.7%(v/v) PEG 400, 2.0M Ammonium sulfate, 19%(w/v) Glycerol, pH 7.1, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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