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4ZJQ

Crystal structure of AcrB deletion mutant in complex with antibiotic in P21 space group

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2014-10-11
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.97625
Spacegroup nameP 1 21 1
Unit cell lengths150.055, 154.575, 215.740
Unit cell angles90.00, 92.42, 90.00
Refinement procedure
Resolution19.963 - 3.592
R-factor0.2494
Rwork0.246
R-free0.31870
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2gif
RMSD bond length0.014
RMSD bond angle1.795
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwarePHENIX (1.8.2_1309)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]125.8303.790
High resolution limit [Å]3.5903.590
Number of reflections114348
<I/σ(I)>5.32
Completeness [%]100.0100
Redundancy6.15.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2880.1 M MES pH 6.5, 0.2 M MgAc, 10% PEG 3350

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