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3ASD

MamA R50E mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID23-1
Synchrotron siteESRF
BeamlineID23-1
Temperature [K]100
Detector technologyCCD
Collection date2010-11-14
DetectorADSC QUANTUM 315r
Wavelength(s)0.972
Spacegroup nameP 43 2 2
Unit cell lengths43.649, 43.649, 207.449
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.710 - 2.450
R-factor0.2745
Rwork0.272
R-free0.32500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3as5
RMSD bond length0.020
RMSD bond angle1.851
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareREFMAC
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0002.490
High resolution limit [Å]2.4506.6502.450
Rmerge0.0480.0310.285
Number of reflections8008
<I/σ(I)>23.4
Completeness [%]98.080100
Redundancy107.110.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6286MES, NaCl, pH 6, VAPOR DIFFUSION, SITTING DROP, temperature 286K

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