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6AMH

Engineered tryptophan synthase b-subunit from Pyrococcus furiosus, PfTrpB4D11 with Ser bound as E(Aex1)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL12-2
Synchrotron siteSSRL
BeamlineBL12-2
Temperature [K]100
Detector technologyPIXEL
Collection date2015-07-23
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9795
Spacegroup nameP 21 21 21
Unit cell lengths84.756, 109.600, 160.882
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution40.000 - 1.630
R-factor0.20782
Rwork0.207
R-free0.23280
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5dw0
RMSD bond length0.006
RMSD bond angle1.154
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0158)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0001.660
High resolution limit [Å]1.6301.630
Rpim0.0351.191
Number of reflections1863789142
<I/σ(I)>12.20.7
Completeness [%]99.999.9
Redundancy6.76.8
CC(1/2)0.9990.327
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.8529815-25% PEG3350 and 0.1 M Na HEPES pH 7.85

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