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7YZS

Crystal structure of the sulfoquinovosyl binding protein SmoF complexed with sulfoquinovose

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2020-01-30
DetectorDECTRIS PILATUS 6M-F
Wavelength(s)0.9763
Spacegroup nameP 31 2 1
Unit cell lengths102.198, 102.198, 67.959
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution88.510 - 1.800
Rwork0.198
R-free0.23400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6ofy
Data reduction softwarexia2
Data scaling softwareAimless
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]88.5101.840
High resolution limit [Å]1.8001.800
Rmerge0.179
Number of reflections382782247
<I/σ(I)>10.1
Completeness [%]100.0
Redundancy19.2
CC(1/2)0.9960.654
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.92830.1 M NaBr, NaI, 0.1 M imidazole, MES pH 6.9, 13.5% MPD, PEG 1000, PEG 3350

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