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6BNE

Crystal structure of the intrinsic colistin resistance enzyme ICR(Mc) from Moraxella catarrhalis, catalytic domain, phosphate-bound complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-D
Synchrotron siteAPS
Beamline21-ID-D
Temperature [K]100
Detector technologyPIXEL
Collection date2016-06-17
DetectorDECTRIS EIGER X 9M
Wavelength(s)1.27424
Spacegroup nameP 41 3 2
Unit cell lengths147.524, 147.524, 147.524
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution60.226 - 2.610
R-factor0.2358
Rwork0.234
R-free0.27050
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4kay
RMSD bond length0.006
RMSD bond angle1.380
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHENIX (phenix.phaser)
Refinement softwarePHENIX ((dev_2733: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]104.3202.680
High resolution limit [Å]2.6102.610
Rmerge3.313
Rpim0.0280.515
Number of reflections173151250
<I/σ(I)>24.72.6
Completeness [%]100.0100
Redundancy77.379.5
CC(1/2)1.0000.840
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.62980.1 M sodium acetate pH 4.6, 1.2 M ammonium sulfate, cryoprotectant 8% glycerol, 8% ethylene glycol and 8% sucrose

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