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3GEI

Crystal structure of MnmE from Chlorobium tepidum in complex with GCP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyCCD
Collection date2006-10-20
DetectorMAR CCD 165 mm
Wavelength(s)0.9796
Spacegroup nameC 2 2 21
Unit cell lengths139.882, 224.572, 156.788
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.940 - 3.400
R-factor0.24624
Rwork0.245
R-free0.26891
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1xzp
RMSD bond length0.008
RMSD bond angle1.198
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0003.425
High resolution limit [Å]3.4003.400
Rmerge0.1290.654
Number of reflections34042
<I/σ(I)>12.132.02
Completeness [%]99.2100
Redundancy7.457.61
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6293100mM MES, 46mM NaOH, 12% PEG 4000, 40mM NaCl, 5mM GCP, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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