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3P30

crystal structure of the cluster II Fab 1281 in complex with HIV-1 gp41 ectodomain

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 24-ID-E
Synchrotron siteAPS
Beamline24-ID-E
Temperature [K]100
Detector technologyCCD
Collection date2010-03-18
DetectorADSC QUANTUM 315
Spacegroup nameH 3
Unit cell lengths115.830, 115.830, 119.544
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution33.440 - 3.300
R-factor0.262
Rwork0.261
R-free0.28900
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.005
RMSD bond angle0.743
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]33.4403.450
High resolution limit [Å]3.3003.310
Rmerge0.0870.425
Number of reflections8478
<I/σ(I)>9.5
Completeness [%]99.599.9
Redundancy3.23.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8298PEG 4000, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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