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9BC3

Transglutaminase 2 - Alternate state

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL12-2
Synchrotron siteSSRL
BeamlineBL12-2
Temperature [K]100
Detector technologyPIXEL
Collection date2022-03-24
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9795
Spacegroup nameP 1
Unit cell lengths46.448, 71.416, 77.473
Unit cell angles90.81, 107.19, 94.43
Refinement procedure
Resolution39.110 - 2.520
R-factor0.20807
Rwork0.205
R-free0.26452
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.002
RMSD bond angle0.940
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0425)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]39.1102.660
High resolution limit [Å]2.5202.520
Rmerge0.0990.416
Rmeas0.1350.567
Rpim0.0920.383
Total number of observations8421
Number of reflections267163835
<I/σ(I)>7.32.2
Completeness [%]83.5
Redundancy2.22.2
CC(1/2)0.9860.708
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP29810% PEG 4K, 10% 2-propanol, 0.1 M HEPES (pH 7.0)

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