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8RR7

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 date2022-01-30
DetectorDECTRIS PILATUS 2M
Wavelength(s)1.00
Spacegroup nameP 21 21 21
Unit cell lengths34.466, 57.704, 62.571
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.200 - 1.600
Rwork0.228
R-free0.25350
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.002
RMSD bond angle1.082
Data reduction softwareautoPROC
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0419)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.2001.620
High resolution limit [Å]1.5901.590
Rmeas0.1451.030
Number of reflections17071854
<I/σ(I)>8.92.3
Completeness [%]98.4
Redundancy6.5
CC(1/2)0.9980.780
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2931.8 M Ammonium citrate pH 7.0

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