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6QF1

X-Ray structure of Proteinase K crystallized on a silicon chip

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPETRA III, DESY BEAMLINE P11
Synchrotron sitePETRA III, DESY
BeamlineP11
Temperature [K]298
Detector technologyPIXEL
Collection date2017-09-22
DetectorDECTRIS PILATUS3 6M
Wavelength(s)1.0
Spacegroup nameP 43 21 2
Unit cell lengths68.467, 68.467, 108.272
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution44.196 - 1.737
R-factor0.1351
Rwork0.134
R-free0.15580
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4b5l
RMSD bond length0.005
RMSD bond angle0.746
Data reduction softwareXDS
Data scaling softwareAimless (0.5.8)
Phasing softwarePHASER
Refinement softwarePHENIX (1.10.1-2155_9999)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]44.1961.770
High resolution limit [Å]1.7371.737
Rmerge0.1430.646
Rmeas0.1500.677
Number of reflections271361465
<I/σ(I)>10.93.4
Completeness [%]99.699.9
Redundancy11.111.3
CC(1/2)0.9970.921
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52950.1M CHC buffer pH 6.5, 0.6M ammonium sulphate, 10mM calcium chloride

217705

건을2024-03-27부터공개중

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