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3EKP

Crystal Structure of the inhibitor Amprenavir (APV) in complex with a multi-drug resistant HIV-1 protease variant (L10I/G48V/I54V/V64I/V82A)Refer: FLAP+ in citation

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsOTHER
Temperature [K]133
Detector technologyIMAGE PLATE
Collection date2005-01-29
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 61
Unit cell lengths91.969, 91.969, 106.222
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution23.750 - 2.150
R-factor0.199
Rwork0.196
R-free0.25400
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.331
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 Overall
Low resolution limit [Å]23.750
High resolution limit [Å]2.150
Rmerge0.054
Number of reflections27531
<I/σ(I)>11.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.2298Refer citation, pH 6.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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