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1KJ7

SUBSTRATE SHAPE DETERMINES SPECIFICITY OF RECOGNITION RECOGNITION FOR HIV-1 PROTEASE: ANALYSIS OF CRYSTAL STRUCTURES OF SIX SUBSTRATE COMPLEXES

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]298
Detector technologyIMAGE PLATE
Collection date2000-01-24
DetectorRIGAKU
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths51.511, 59.426, 61.735
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution32.930 - 2.000
R-factor0.206
Rwork0.206
R-free0.24900
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1f7a
RMSD bond length0.006
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 Overall
Low resolution limit [Å]32.930
High resolution limit [Å]2.000
Rmerge0.047
Number of reflections12913
<I/σ(I)>9.7
Completeness [%]96.7
Redundancy5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1

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