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1B9D

MOBILITY OF AN HIV-1 INTEGRASE ACTIVE SITE LOOP IS CORRELATED WITH CATALYTIC ACTIVITY

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.2
Synchrotron siteALS
Beamline5.0.2
Temperature [K]100
Detector technologyCCD
Collection date1998-01-15
DetectorADSC
Wavelength(s)1.0162,1.0596
Spacegroup nameP 31 2 1
Unit cell lengths72.350, 72.350, 65.720
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 1.700
R-factor0.224

*

Rwork0.224
R-free0.27800
Structure solution methodMAD
RMSD bond length0.020
RMSD bond angle0.033
Data reduction softwareMOSFLM
Data scaling softwareCCP4 ((SCALA))
Phasing softwareMLPHARE
Refinement softwareREFMAC
Data quality characteristics
 Overall
Low resolution limit [Å]20.000
High resolution limit [Å]1.700
Rmerge0.042

*

Number of reflections20854
Completeness [%]99.2
Redundancy3.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

*

6.54

*

pH 6.5
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirPEG800015 (%)
21reservoircacodylic acid100 (mM)
31reservoirammonium sulfate200 (mM)
41reservoirdithiothreitol5 (mM)
51reservoir5 (mM)
61reservoir5 (mM)

218853

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