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3K1B

Structure of OmpF porin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.2.1
Synchrotron siteALS
Beamline8.2.1
Temperature [K]100
Detector technologyCCD
Collection date2009-02-12
DetectorADSC QUANTUM 315r
Wavelength(s)0.97930
Spacegroup nameP 3 2 1
Unit cell lengths215.529, 215.529, 137.465
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 4.390
R-factor0.26695
Rwork0.264
R-free0.32887
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2omf
RMSD bond length0.027
RMSD bond angle2.857
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareBALBES
Refinement softwareREFMAC (5.5.0066)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0004.480
High resolution limit [Å]4.4004.400
Rmerge0.2110.512
Number of reflections23572
<I/σ(I)>7.7783
Completeness [%]99.299.2
Redundancy5.85.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION3.92930.48 sodium phosphate monobasic, 0.72 M potassium phosphate monobasic, 0.1 M acetate pH 3.9, VAPOR DIFFUSION, temperature 293K

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