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7HLM

PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with Z29077827

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04-1
Synchrotron siteDiamond
BeamlineI04-1
Temperature [K]100
Detector technologyPIXEL
Collection date2024-05-22
DetectorDECTRIS EIGER2 XE 9M
Wavelength(s)0.92124
Spacegroup nameI 4
Unit cell lengths95.509, 95.509, 45.883
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution33.790 - 1.150
R-factor0.1779
Rwork0.177
R-free0.19170
Structure solution methodFOURIER SYNTHESIS
RMSD bond length0.014
RMSD bond angle1.948
Data reduction softwareXDS
Data scaling softwareAimless (0.7.7)
Phasing softwareREFMAC
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]33.76033.7601.170
High resolution limit [Å]1.1506.3001.150
Rmerge0.0280.0380.147
Rmeas0.0290.0400.208
Rpim0.0080.0130.147
Total number of observations5881955893441
Number of reflections61914485434
<I/σ(I)>43131.61.7
Completeness [%]84.399.512.1
Redundancy9.512.21
CC(1/2)0.9990.9940.947
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP82934 % PEG 400, 2 M AmmSO4, 0.1 M HEPES pH 8

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