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3IV2

Crystal structure of mature apo-Cathepsin L C25A mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 23-ID-B
Synchrotron siteAPS
Beamline23-ID-B
Temperature [K]100
Detector technologyCCD
Collection date2009-04-06
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)1.0809
Spacegroup nameP 32 2 1
Unit cell lengths61.959, 61.959, 206.288
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution25.000 - 2.200
R-factor0.20419
Rwork0.202
R-free0.24376
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.005
RMSD bond angle0.703
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0102)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0002.280
High resolution limit [Å]2.2002.200
Number of reflections24149
<I/σ(I)>20.92.3
Completeness [%]99.299.4
Redundancy5.24.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.62930.2 M Ammonium sulfate, 0.1 M Sodium acetate trihydrate pH 4.6, 30% PEG MME 2000, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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