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8PDH

The phosphatase and C2 domains of SHIP1 with covalent Z1742148362

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 date2021-04-24
DetectorDECTRIS EIGER2 XE 16M
Wavelength(s)0.9763
Spacegroup nameP 21 21 21
Unit cell lengths62.508, 79.171, 89.378
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution51.276 - 1.450
Rwork0.144
R-free0.20180
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.013
RMSD bond angle1.753
Data reduction softwareDIALS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]79.2001.470
High resolution limit [Å]1.4501.450
Number of reflections792873864
<I/σ(I)>8
Completeness [%]100.0100
Redundancy12.9
CC(1/2)0.9980.453
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.529330 mM sodium nitrate, 30 mM dibasic sodium phosphate, 30 mM ammonium sulphate, 100 mM MES/imidazole, 20 % PEG 500 MME, 10% PEG 20,000

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