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9CSG

Human Serum Albumin Bound to Cerastecin Compound 5e

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Temperature [K]100
Detector technologyPIXEL
Collection date2019-07-25
DetectorDECTRIS PILATUS 6M
Wavelength(s)1.0
Spacegroup nameC 1 2 1
Unit cell lengths172.647, 38.624, 97.780
Unit cell angles90.00, 104.89, 90.00
Refinement procedure
Resolution94.500 - 1.914
R-factor0.2316
Rwork0.230
R-free0.26200
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle0.850
Data reduction softwareautoPROC
Data scaling softwareautoPROC ((Version 1.1.7))
Phasing softwarePHASER
Refinement softwareBUSTER (2.11.8 (23-JAN-2024))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]94.5002.120
High resolution limit [Å]1.9101.910
Number of reflections302881514
<I/σ(I)>9.5
Completeness [%]62.1
Redundancy6.2
CC(1/2)0.9980.968
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP29125-30% PEG 3350, 50 mM potassium phosphate, pH 7.5

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