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1PM9

CRYSTAL STRUCTURE OF HUMAN MNSOD H30N, Y166F MUTANT

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.2
Synchrotron siteALS
Beamline5.0.2
Temperature [K]100
Detector technologyCCD
Collection date2001-12-21
DetectorADSC QUANTUM 4
Wavelength(s)1.00
Spacegroup nameP 21 21 2
Unit cell lengths71.580, 76.460, 66.610
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 1.700
R-factor0.215
Rwork0.215
R-free0.24000

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Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ABM
RMSD bond length0.006
RMSD bond angle20.900

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.730
High resolution limit [Å]1.7001.700
Rmerge0.0600.380

*

Number of reflections40814
<I/σ(I)>18.63
Completeness [%]99.096

*

Redundancy3.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION7.6298potassium, PEG 3350, pH 7.6, VAPOR DIFFUSION, temperature 298K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein6 (mg/ml)
21reservoirpotassium phosphate25 (mM)pH7.6
31reservoirPEG335025 (%)

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