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4UB0

New design for monovalent bispecific IgG through cysteine engineering of the CH1-CL interface

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Temperature [K]100
Detector technologyPIXEL
Collection date2011-10-20
DetectorPSI PILATUS 6M
Wavelength(s)0.97931
Spacegroup nameC 1 2 1
Unit cell lengths126.154, 64.045, 82.395
Unit cell angles90.00, 129.09, 90.00
Refinement procedure
Resolution53.600 - 2.200
R-factor0.23308
Rwork0.232
R-free0.25202
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.005
RMSD bond angle1.027
Refinement softwareREFMAC (5.8.0049)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]53.6002.310
High resolution limit [Å]2.2002.200
Rmerge0.397
Number of reflections25434
<I/σ(I)>11.62.8
Completeness [%]97.497.9
Redundancy3.83.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP293protein @ 19 mg/ml in 10 mM Tris-HCl, pH 8.0, 100 mM NaCl; 0.018 M of each of the following salt solutions: CaCl2, CoCl2, and CdCl2; 18% PEG 3350 and 5% glycerol

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