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1JP9

Sperm Whale met-Myoglobin (low temperature; high pressure)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE F1
Synchrotron siteCHESS
BeamlineF1
Temperature [K]95
Detector technologyCCD
Collection date2000-02-02
DetectorADSC QUANTUM 4
Wavelength(s)0.9503
Spacegroup nameP 1 21 1
Unit cell lengths64.079, 30.777, 34.404
Unit cell angles90.00, 105.42, 90.00
Refinement procedure
Resolution26.000

*

- 1.700
R-factor0.21

*

Rwork0.210
R-free0.24700
Starting model (for MR)1vxh
RMSD bond length0.005
RMSD bond angle0.975

*

Data reduction softwareDPS
Data scaling softwareCCP4 ((SCALA))
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]26.0001.810
High resolution limit [Å]1.7001.670
Rmerge0.0750.096
Number of reflections14428
<I/σ(I)>4.86.8
Completeness [%]98.597.7
Redundancy43.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Batch method

*

6298ammonium sulfate, pH 6, batch, temperature 298K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
111ammonium sulfate72-78 (%sat)pH5.5-6.0

218853

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