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3FKW

AmpC K67R mutant apo structure

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.3.1
Synchrotron siteALS
Beamline8.3.1
Temperature [K]100
Detector technologyCCD
Collection date2006-07-25
DetectorADSC QUANTUM 4
Wavelength(s)1.11587
Spacegroup nameC 1 2 1
Unit cell lengths118.348, 76.564, 97.702
Unit cell angles90.00, 115.82, 90.00
Refinement procedure
Resolution88.050 - 1.498
R-factor0.167
Rwork0.166
R-free0.19900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)PDB ID 1KE4
RMSD bond length0.009
RMSD bond angle1.236
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareREFMAC (5.2)
Refinement softwareREFMAC
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]88.05050.0001.550
High resolution limit [Å]1.4983.2301.498
Rmerge0.0510.0350.513
Number of reflections120185
<I/σ(I)>16.662
Completeness [%]95.798.490.9
Redundancy2.52.42.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.7293Potassium Phosphate, pH 8.7, vapor diffusion, hanging drop, temperature 293K

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