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3ECH

The MarR-family repressor MexR in complex with its antirepressor ArmR

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.2.2
Synchrotron siteALS
Beamline8.2.2
Temperature [K]100
Detector technologyCCD
DetectorADSC QUANTUM 315
Wavelength(s)1.0000
Spacegroup nameP 21 21 21
Unit cell lengths52.201, 57.151, 91.931
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.560 - 1.802
R-factor0.1782
Rwork0.176
R-free0.22910
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1lnw
RMSD bond length0.014
RMSD bond angle1.401
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.2)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]48.5601.860
High resolution limit [Å]1.8021.802
Number of reflections26074
<I/σ(I)>35.13
Redundancy7.98
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1MICROBATCH5.529120% PEG 3000, 0.1M sodium citrate, pH 5.5, microbatch, temperature 291K

219869

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