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8RRC

Galectin-3 with a small molecule inhibitor

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06DA
Synchrotron siteSLS
BeamlineX06DA
Temperature [K]100
Detector technologyPIXEL
Collection date2021-06-28
DetectorDECTRIS PILATUS 2M
Wavelength(s)1.00
Spacegroup nameP 21 21 21
Unit cell lengths34.804, 57.280, 61.850
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.004 - 1.500
Rwork0.192
R-free0.23620
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.612
Data reduction softwareautoPROC
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0419)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.0201.530
High resolution limit [Å]1.4501.450
Rmeas0.1231.720
Number of reflections424456726
<I/σ(I)>6.590.74
Completeness [%]99.3
Redundancy3.37
CC(1/2)0.9970.247
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP29360% "Tacsimate" pH 7.0 (Hampton Research)

246031

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