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1N1P

ATOMIC RESOLUTION STRUCTURE OF CHOLESTEROL OXIDASE @ pH 7.4 (STREPTOMYCES SP. SA-COO)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X8C
Synchrotron siteNSLS
BeamlineX8C
Temperature [K]100
Detector technologyCCD
Collection date1999-08-26
DetectorADSC
Wavelength(s)0.979
Spacegroup nameP 1 21 1
Unit cell lengths51.273, 72.964, 63.036
Unit cell angles90.00, 105.18, 90.00
Refinement procedure
Resolution49.000 - 0.950
Rwork0.097
R-free0.11900

*

Structure solution methodAB INITIO PHASING
Starting model (for MR)1mxt
RMSD bond length0.015
RMSD bond angle0.030
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSHELX
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]49.0000.970
High resolution limit [Å]0.9500.950
Rmerge0.0490.349
Total number of observations2567129

*

Number of reflections277783
<I/σ(I)>19.42.2
Completeness [%]98.898.8
Redundancy3.73
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

*

9

*

290PEG 8000, MANGANESE SULFATE,GLYCINE, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 290K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirPEG MW 800012 (%)
21reservoir75 (mM)
31reservoirglycine100 (mM)pH9.0

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