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2P47

Complex of a camelid single-domain vhh antibody fragment with RNASE A at 2.5A resolution: SE5B-TRI crystal form with five se-met sites (L4M, M34, M51, F68M, M83) in vhh scaffold.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Temperature [K]100
Detector technologyCCD
Collection date2004-04-01
DetectorADSC QUANTUM 210
Wavelength(s)0.97934
Spacegroup nameP 31 2 1
Unit cell lengths72.011, 72.011, 98.012
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 2.500
R-factor0.23295
Rwork0.230
R-free0.29438
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)PDB ID 2P45
RMSD bond length0.008
RMSD bond angle1.216
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.1.9999)
Data quality characteristics
 Overall
Low resolution limit [Å]20.000
High resolution limit [Å]2.500
Number of reflections10142
Completeness [%]96.1
Redundancy4.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION7.5295HAMPTON RESEARCH INDEX SCREEN, SOLUTION #68: (NH4)SO4, PEG 3350, HEPES BUFFER, PH 7.5, VAPOR DIFFUSION, temperature 295K

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