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1YY9

Structure of the extracellular domain of the epidermal growth factor receptor in complex with the Fab fragment of cetuximab/Erbitux/IMC-C225

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE A1
Synchrotron siteCHESS
BeamlineA1
Temperature [K]100
Detector technologyCCD
DetectorADSC QUANTUM 210
Wavelength(s)0.976
Spacegroup nameP 1 21 1
Unit cell lengths77.823, 70.861, 147.122
Unit cell angles90.00, 102.48, 90.00
Refinement procedure
Resolution40.000 - 2.605
R-factor0.24187
Rwork0.239
R-free0.28896
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1NQL and 1YY8
RMSD bond length0.015
RMSD bond angle1.680
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.690
High resolution limit [Å]2.6002.600
Rmerge0.0600.850
Number of reflections47467
<I/σ(I)>15.92
Completeness [%]98.8
Redundancy3.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5300PEG 3450, Ammonium sulfate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 300K

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