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3F4Y

HIV gp41 six-helix bundle containing a mutant CHR alpha-peptide sequence

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyCCD
Collection date2007-11-05
DetectorBRUKER SMART 6000
Wavelength(s)1.5418
Spacegroup nameP 21 21 2
Unit cell lengths37.611, 179.038, 33.075
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution25.000 - 2.000
R-factor0.212
Rwork0.209
R-free0.26000
RMSD bond length0.013
RMSD bond angle1.146
Data reduction softwarePROTEUM PLUS (PLUS)
Data scaling softwarePROTEUM PLUS (PLUS)
Phasing softwarePHASER
Refinement softwareREFMAC (5.3.0037)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]44.8002.100
High resolution limit [Å]2.0002.000
Number of reflections15938
<I/σ(I)>284.7
Completeness [%]99.9100
Redundancy8.63.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.52980.1 M Tris pH 8.5, 1 M ammonium phosphate monobasic, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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