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8VQN

Crystal structure of the A/Puerto Rico/8/1934 (H1N1) influenza virus hemagglutinin in complex with small molecule 6R

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL12-1
Synchrotron siteSSRL
BeamlineBL12-1
Temperature [K]100
Detector technologyPIXEL
Collection date2023-11-20
DetectorDECTRIS EIGER X 16M
Wavelength(s)0.97946
Spacegroup nameI 21 3
Unit cell lengths159.654, 159.654, 159.654
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.670 - 2.210
R-factor0.2033
Rwork0.202
R-free0.23240
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.002
RMSD bond angle0.489
Data scaling softwareHKL-3000
Phasing softwarePHASER
Refinement softwarePHENIX ((1.20.1_4487: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.7002.290
High resolution limit [Å]2.2002.200
Rmeas0.2701.800
Rpim0.0700.650
Number of reflections3389033755
<I/σ(I)>16.4
Completeness [%]100.0
Redundancy18.6
CC(1/2)0.9600.760
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2930.1M Tris, 1M Lithium Chloride, 20% PEG6000, PH8

222036

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