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1B92

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

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsMACSCIENCE
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1998-05
DetectorMACSCIENCE
Spacegroup nameP 31 2 1
Unit cell lengths72.260, 72.260, 65.600
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 2.020
R-factor0.219

*

Rwork0.225
R-free0.28900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1b9d
RMSD bond length0.019

*

RMSD bond angle0.037

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCCP4
Refinement softwareREFMAC
Data quality characteristics
 Overall
Low resolution limit [Å]20.000

*

High resolution limit [Å]2.000

*

Rmerge0.039

*

Number of reflections13085
<I/σ(I)>11.9
Completeness [%]98.5
Redundancy4.6
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)

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