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1BWB

HIV-1 PROTEASE (V82F/I84V) DOUBLE MUTANT COMPLEXED WITH SD146 OF DUPONT PHARMACEUTICALS

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Temperature [K]278
Spacegroup nameP 61
Unit cell lengths62.800, 62.800, 83.500
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 1.800
R-factor0.199
Rwork0.199
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.012
RMSD bond angle2.900
Refinement softwareX-PLOR
Data quality characteristics
 Overall
Low resolution limit [Å]20.000
High resolution limit [Å]1.800
Rmerge0.079

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Total number of observations99302

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Number of reflections17416
Completeness [%]99.0
Redundancy5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

*

6.518

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pH 6.5
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein1 (mg/ml)
21dropacetate250 (mM)
31dropammonium sulfate80-240 (mM)
41dropinhibitor1000-fold molar excess

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PDB entries from 2024-11-06

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