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4ZME

Crystal Structure of the Alpha-kinase Domain of Myosin-II Heavy Chain Kinase A in Complex with Adenosine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE F1
Synchrotron siteCHESS
BeamlineF1
Temperature [K]100
Detector technologyCCD
Collection date2007-06-20
DetectorADSC QUANTUM 270
Wavelength(s)0.918
Spacegroup nameP 21 21 2
Unit cell lengths83.194, 111.288, 79.560
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution79.560 - 1.980
R-factor0.2148
Rwork0.214
R-free0.23610
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3lkm
RMSD bond length0.009
RMSD bond angle1.490
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0073)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]79.5602.070
High resolution limit [Å]1.9801.980
Rmerge0.0900.430
Number of reflections51052
<I/σ(I)>6.96.45
Completeness [%]99.599.9
Redundancy6.94.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.4277.15PEG 8000, sodium phosphate, cacodylate

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