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2BLH

Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsENRAF-NONIUS FR591
Temperature [K]295
Detector technologyAREA DETECTOR
Collection date2003-09-19
DetectorBRUKER, MULTIWIRE
Spacegroup nameP 6
Unit cell lengths92.420, 92.420, 46.790
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 1.770
R-factor0.1865
Rwork0.186
R-free0.20240
Structure solution methodOTHER
RMSD bond length0.008
RMSD bond angle1.031
Data reduction softwareSAINT
Data scaling softwareSAINT
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.860
High resolution limit [Å]1.7701.770
Rmerge0.0300.180
Number of reflections81268
<I/σ(I)>18.14.2
Completeness [%]89.451
Redundancy4.21.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.82.8 M AMMONIUM SULFATE, 25 MM TRIS, 1 MM EDTA, PH 8.0

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