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7GQ0

PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3C Protease in complex with NCL-00025345

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04-1
Synchrotron siteDiamond
BeamlineI04-1
Temperature [K]100
Detector technologyPIXEL
Collection date2023-01-27
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.92124
Spacegroup nameP 21 21 21
Unit cell lengths42.674, 62.447, 147.803
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution38.710 - 1.510
R-factor0.1986
Rwork0.197
R-free0.22149
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.528
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]38.6801.540
High resolution limit [Å]1.5101.510
Rmerge0.0962.542
Rmeas0.1002.672
Rpim0.0270.804
Total number of observations81181730712
Number of reflections615812884
<I/σ(I)>9.20.2
Completeness [%]98.3
Redundancy13.210.6
CC(1/2)0.9990.228
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.1429825% PEG 3350, 0.1M Tris, 0.2M Ammonium acetate

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