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7JOS

Crystal structure of BbKI complexed with Human Kallikrein 4

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-ID
Synchrotron siteAPS
Beamline22-ID
Temperature [K]100
Detector technologyPIXEL
Collection date2019-02-16
DetectorDECTRIS EIGER X 16M
Wavelength(s)1.000
Spacegroup nameP 1 21 1
Unit cell lengths92.143, 117.195, 159.417
Unit cell angles90.00, 89.57, 90.00
Refinement procedure
Resolution49.494 - 2.100
Rwork0.184
R-free0.21220
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)7jod
RMSD bond length0.009
RMSD bond angle1.518
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0258)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.140
High resolution limit [Å]2.1002.100
Number of reflections1929407985
<I/σ(I)>15.93
Completeness [%]97.4
Redundancy3.41.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP29325% PEG3350, 0.2M NaCl

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