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8OKV

lipoprotein BT2095 from Bacteroides thetaiotamicron bound to cyanocobalamin CnCbl

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2021-03-03
DetectorDECTRIS EIGER2 XE 16M
Wavelength(s)0.9794
Spacegroup nameP 21 21 21
Unit cell lengths74.770, 131.040, 179.380
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution74.123 - 2.600
Rwork0.218
R-free0.27600
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.014
RMSD bond angle2.466
Data reduction softwarexia2
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0352)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]74.7002.680
High resolution limit [Å]2.6002.600
Rpim0.060
Number of reflections546784401
<I/σ(I)>11.81.1
Completeness [%]99.4
Redundancy13.2
CC(1/2)0.9900.660
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP293Optimised from Index H8, 0.1MgFormate 15% PEG 3350

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