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3IDI

Crystal structure of the HIV-1 Cross Neutralizing Monoclonal Antibody 2F5 Fab' fragment in complex with gp41 Peptide ALDKWNQ

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2008-06-16
DetectorRIGAKU RAXIS IV
Wavelength(s)1.54
Spacegroup nameP 21 21 21
Unit cell lengths63.500, 76.500, 94.200
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution28.150 - 2.100
R-factor0.212
Rwork0.212
R-free0.23000
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.800
Data reduction softwareCrystalClear
Data scaling softwareCrystalClear
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.200
High resolution limit [Å]2.1002.100
Number of reflections25395
<I/σ(I)>25.33.2
Completeness [%]92.584.8
Redundancy5.13.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.62930.1 M sodium citrate, pH 5.6, 16% 2-propanol, 16% PEG 4000, 0.1% Tween-20, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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