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3NAB

Crystal Structure of fab15 Mut6

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Detector technologyCCD
Collection date2010-03-17
DetectorADSC QUANTUM 210
Wavelength(s)1.0000
Spacegroup nameP 1 21 1
Unit cell lengths54.618, 75.197, 67.226
Unit cell angles90.00, 108.93, 90.00
Refinement procedure
Resolution34.935 - 2.320
R-factor0.2064
Rwork0.203
R-free0.25920
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3na9
RMSD bond length0.008
RMSD bond angle1.082
Data reduction softwared*TREK
Data scaling softwared*TREK
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.6.1_357))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.6002.400
High resolution limit [Å]2.3202.320
Rmerge0.0830.323
Number of reflections22257
<I/σ(I)>8.62.5
Completeness [%]99.3100
Redundancy3.643.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.52930.1 M sodium acetate, 12% PEG MME 5000, 0.2 M Zn acetate, pH 4.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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