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4OMC

X-ray structure of human furin in complex with the competitive inhibitor meta-guanidinomethyl-Phac-RVR-Amba

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyPIXEL
Collection date2013-05-29
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.918
Spacegroup nameP 21 21 21
Unit cell lengths141.178, 152.849, 168.306
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 2.300
Rwork0.185
R-free0.21640
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.440
High resolution limit [Å]2.3002.300
Number of reflections160915
<I/σ(I)>9.692.63
Completeness [%]99.498.5
Redundancy3.83.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.529350mM Tris, 2.8M sodium formate, 0.015mM Cymal-7, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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