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3KYK

Crystal structure of li33 Igg1 Fab

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 31-ID
Synchrotron siteAPS
Beamline31-ID
Temperature [K]93
Detector technologyIMAGE PLATE
Collection date2006-12-06
DetectorMAR scanner 345 mm plate
Wavelength(s)0.97961
Spacegroup nameP 65 2 2
Unit cell lengths90.632, 90.632, 215.041
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution44.340 - 3.200
R-factor0.198
Rwork0.194
R-free0.29000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2b2x
RMSD bond length0.023
RMSD bond angle2.381
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER (1.3.2)
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0003.310
High resolution limit [Å]3.2003.200
Rmerge0.2210.571
Number of reflections9258
<I/σ(I)>3.5
Completeness [%]100.0100
Redundancy17.817.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP3.52932M ammonium sulfate, 0.1M sodium acetate pH 3.5 and 0.1M TCEP, vapor diffusion, hanging drop, temperature 293K

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