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3L3V

Structure of HIV-1 integrase core domain in complex with sucrose

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 23-ID-D
Synchrotron siteAPS
Beamline23-ID-D
Temperature [K]100
Detector technologyCCD
Collection date2007-02-14
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)1.0
Spacegroup nameP 21 21 21
Unit cell lengths60.085, 60.714, 81.463
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution40.731 - 2.000
R-factor0.1964
Rwork0.194
R-free0.24420
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1exq
RMSD bond length0.008
RMSD bond angle1.129
Data reduction softwareMOSFLM
Data scaling softwareSCALA (3.3.9)
Phasing softwareAMoRE
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]81.4632.100
High resolution limit [Å]2.0002.000
Rmerge0.410
Number of reflections20793
<I/σ(I)>4.4
Completeness [%]100.0100
Redundancy7.27.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.62931.8M ammonium sulfate, 0.15M sodium citrate, 5mM cadmium chloride, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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