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yCP beta5-M45A mutant in complex with carfilzomib

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2013-08-14
DetectorPSI PILATUS 6M
Wavelength(s)1.0
Spacegroup nameP 1 21 1
Unit cell lengths135.550, 300.110, 145.150
Unit cell angles90.00, 113.00, 90.00
Refinement procedure
Resolution15.000 - 3.000
R-factor0.17086
Rwork0.169
R-free0.20062
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ryp
RMSD bond length0.005
RMSD bond angle0.872
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwareREFMAC
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0003.100
High resolution limit [Å]3.0003.000
Rmerge0.0820.475
Number of reflections210752
<I/σ(I)>13.22.4
Completeness [%]99.199.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.829320 MM MGAC2, 13% MPD, PH 6.8, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K

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