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1UXL

I113T mutant of human SOD1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSRS BEAMLINE PX14.2
Synchrotron siteSRS
BeamlinePX14.2
Temperature [K]100
Detector technologyCCD
Collection date2002-11-15
DetectorADSC CCD
Spacegroup nameC 2 2 21
Unit cell lengths166.042, 203.546, 144.021
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 1.600
R-factor0.172
Rwork0.170
R-free0.18800

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Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1hl5
RMSD bond length0.016

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RMSD bond angle1.600

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Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.660
High resolution limit [Å]1.6001.600
Rmerge0.0510.420

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Number of reflections317774
<I/σ(I)>153
Completeness [%]99.699.7
Redundancy105
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

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7.5100 MM NACL, 2.4M AMMONIUM SULPHATE PH 7.5
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein10 (mg/ml)
21reservoirPEG200015 (%)
31reservoircalcium acetate0.2 (M)
41reservoirammonium sulfate2.4 (M)
51reservoir100 (mM)
61reservoirTris-HCl100 (mM)pH7.5

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