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3ECL

Carbonmonoxy Sperm Whale Myoglobin at 40 K: Laser on

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE AR-NW14A
Synchrotron sitePhoton Factory
BeamlineAR-NW14A
Temperature [K]40
Detector technologyCCD
Collection date2007-05-24
DetectorMAR CCD 165 mm
Wavelength(s)0.827
Spacegroup nameP 1 21 1
Unit cell lengths34.310, 30.630, 63.729
Unit cell angles90.00, 105.76, 90.00
Refinement procedure
Resolution19.930 - 1.210
R-factor0.145
Rwork0.143
R-free0.17900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1mbc
RMSD bond length0.020
RMSD bond angle1.933
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareREFMAC
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0001.250
High resolution limit [Å]1.2102.6101.210
Rmerge0.0330.0220.204
Number of reflections37319
<I/σ(I)>15.1
Completeness [%]95.592.681.1
Redundancy3.73.73.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1batch62932.4M Ammonium sulfate, 10mM TrisHCl, 100mM Sodium phosphate, pH 6.0, batch, temperature 293K

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