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6H6G

Crystal Structure of TcdB2-TccC3 without hypervariable C-terminal region

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyPIXEL
Collection date2017-02-06
DetectorPSI PILATUS 6M
Wavelength(s)0.97794
Spacegroup nameP 32 2 1
Unit cell lengths231.330, 231.330, 141.970
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution48.639 - 3.004
R-factor0.2175
Rwork0.216
R-free0.25310
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4o9x
RMSD bond length0.003
RMSD bond angle0.568
Data reduction softwareXDS (BUILT=20160617)
Data scaling softwareXSCALE (BUILT=20160617)
Phasing softwarePHASER (2.5.6)
Refinement softwarePHENIX ((1.11.1_2575: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0003.080
High resolution limit [Å]3.0003.000
Rmerge0.575
Rmeas0.590
Rpim0.129
Number of reflections87208
<I/σ(I)>7.3
Completeness [%]99.9
Redundancy20
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP293.150.1 M tri-sodium citrate pH 5.5, 10 % PEG 8000, 10 % ethylenglycol

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