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9YRR

HIV-1 Protease WT (NL4-3) in Complex with LR4-44

Replaces:  7M9R
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007 HF
Temperature [K]100
Detector technologyCCD
Collection date2018-11-18
DetectorRIGAKU SATURN 944
Wavelength(s)1.54178
Spacegroup nameP 21 21 21
Unit cell lengths50.909, 58.799, 61.637
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution23.530 - 1.890
R-factor0.1835
Rwork0.181
R-free0.22720
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.003
RMSD bond angle0.594
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX (1.20.1_4487)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]23.5301.960
High resolution limit [Å]1.8901.890
Rmerge0.0590.382
Number of reflections145441281
<I/σ(I)>30.64.2
Completeness [%]94.985.4
Redundancy7.36.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP29323-24% (w/v) Ammonium Sulfate, 0.1M Bis-Tris-Methane-HCl Buffer pH 5.5

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