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2BB9

Structure of HIV1 protease and AKC4p_133a complex.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Temperature [K]93
Detector technologyCCD
Collection date2005-01-13
DetectorADSC QUANTUM 4
Wavelength(s)1.0
Spacegroup nameP 21 21 2
Unit cell lengths58.238, 86.180, 46.533
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.550 - 1.350
Rwork0.237
R-free0.26100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR): 1NPW
RMSD bond length0.013
RMSD bond angle2.000
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNX (2000.1)
Refinement softwareCNX (2000.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.400
High resolution limit [Å]1.3501.350
Number of reflections37834
<I/σ(I)>392.8
Completeness [%]72.421
Redundancy6.13.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.2298600MM NACL, 100MM SODIUM ACETATE BUFFER AT PH 5.2, VAPOR DIFFUSION, HANGING DROP , temperature 298K

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