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- PDB-8qqn: Portal protein of full Haloferax tailed virus 1. -

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Basic information

Entry
Database: PDB / ID: 8qqn
TitlePortal protein of full Haloferax tailed virus 1.
Components
  • HK97 gp6-like/SPP1 gp15-like head-tail connector
  • Portal protein
KeywordsVIRUS / Archaeal virus / portal / portal capsid interface / Mg ions
Function / homologyPortal protein / HK97 gp6-like/SPP1 gp15-like head-tail connector
Function and homology information
Biological speciesHaloferax tailed virus 1
MethodELECTRON MICROSCOPY / single particle reconstruction / cryo EM / Resolution: 2.342 Å
AuthorsZhang, D. / Daum, B. / Isupov, M.N. / McLaren, M.
Funding supportEuropean Union, 1items
OrganizationGrant numberCountry
European Research Council (ERC)European Union
CitationJournal: To Be Published
Title: CryoEM structure of Haloferax tailed virus 1
Authors: Zhang, D. / Daum, B. / Isupov, M.N. / McLaren, M. / Oksanen, H. / Quax, T.E.F. / Schwarzer, S. / Gold, V.A.M. / Antson, A.
History
DepositionOct 5, 2023Deposition site: PDBE / Processing site: PDBE
Revision 1.0Oct 16, 2024Provider: repository / Type: Initial release

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
PX: HK97 gp6-like/SPP1 gp15-like head-tail connector
PA: Portal protein
PB: Portal protein
PC: Portal protein
PD: Portal protein
PE: Portal protein
PF: Portal protein
PG: Portal protein
PH: Portal protein
PI: Portal protein
PJ: Portal protein
PK: Portal protein
PL: Portal protein
PM: HK97 gp6-like/SPP1 gp15-like head-tail connector
PN: HK97 gp6-like/SPP1 gp15-like head-tail connector
PO: HK97 gp6-like/SPP1 gp15-like head-tail connector
PP: HK97 gp6-like/SPP1 gp15-like head-tail connector
PQ: HK97 gp6-like/SPP1 gp15-like head-tail connector
PR: HK97 gp6-like/SPP1 gp15-like head-tail connector
PS: HK97 gp6-like/SPP1 gp15-like head-tail connector
PT: HK97 gp6-like/SPP1 gp15-like head-tail connector
PU: HK97 gp6-like/SPP1 gp15-like head-tail connector
PV: HK97 gp6-like/SPP1 gp15-like head-tail connector
PW: HK97 gp6-like/SPP1 gp15-like head-tail connector
hetero molecules


Theoretical massNumber of molelcules
Total (without water)1,095,49336
Polymers1,095,20124
Non-polymers29212
Water00
1


  • Idetical with deposited unit
  • defined by author&software
  • Evidence: electron microscopy, not applicable
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1

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Components

#1: Protein
HK97 gp6-like/SPP1 gp15-like head-tail connector


Mass: 15585.868 Da / Num. of mol.: 12 / Source method: isolated from a natural source / Source: (natural) Haloferax tailed virus 1 / References: UniProt: A0A410N6S3
#2: Protein
Portal protein


Mass: 75680.906 Da / Num. of mol.: 12 / Source method: isolated from a natural source / Source: (natural) Haloferax tailed virus 1 / References: UniProt: A0A410N6Q2
#3: Chemical
ChemComp-MG / MAGNESIUM ION


Mass: 24.305 Da / Num. of mol.: 12 / Source method: obtained synthetically / Formula: Mg / Feature type: SUBJECT OF INVESTIGATION
Has ligand of interestY
Has protein modificationY

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Experimental details

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Experiment

ExperimentMethod: ELECTRON MICROSCOPY
EM experimentAggregation state: PARTICLE / 3D reconstruction method: single particle reconstruction

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Sample preparation

ComponentName: Haloferax tailed virus 1 / Type: VIRUS / Entity ID: #1-#2 / Source: NATURAL
Source (natural)Organism: Haloferax tailed virus 1
Details of virusEmpty: NO / Enveloped: NO / Isolate: OTHER / Type: VIRION
Natural hostOrganism: Haloferax gibbonsii
Buffer solutionpH: 7
SpecimenEmbedding applied: NO / Shadowing applied: NO / Staining applied: NO / Vitrification applied: YES
VitrificationCryogen name: ETHANE

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Electron microscopy imaging

Experimental equipment
Model: Titan Krios / Image courtesy: FEI Company
MicroscopyModel: TFS KRIOS
Electron gunElectron source: FIELD EMISSION GUN / Accelerating voltage: 300 kV / Illumination mode: FLOOD BEAM
Electron lensMode: BRIGHT FIELD / Nominal defocus max: 2000 nm / Nominal defocus min: 800 nm / Cs: 2.7 mm
Image recording
IDImaging-IDElectron dose (e/Å2)Film or detector model
1150TFS FALCON 4i (4k x 4k)
2154.6GATAN K3 (6k x 4k)

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Processing

EM software
IDNameVersionCategory
2EPU5image acquisition
4RELION4.0-betaCTF correction
7Cootmodel fitting
8UCSF ChimeraXmodel fitting
9ISOLDEmodel fitting
11REFMACmodel refinement
Image processingDetails: Dataset produced as a combination of both FALCON 4i and K3 collections
CTF correctionType: PHASE FLIPPING AND AMPLITUDE CORRECTION
3D reconstructionResolution: 2.342 Å / Resolution method: FSC 0.143 CUT-OFF / Num. of particles: 165198 / Symmetry type: POINT
Atomic model buildingProtocol: AB INITIO MODEL / Space: RECIPROCAL
Atomic model buildingType: in silico model
RefinementResolution: 2.342→2.342 Å / Cor.coef. Fo:Fc: 0.747 / WRfactor Rwork: 0.406 / SU B: 3.213 / SU ML: 0.068 / Average fsc overall: 0.5921 / Average fsc work: 0.5921 / ESU R: 0.065 / Details: Hydrogens have not been used
RfactorNum. reflection% reflection
Rwork0.4063 11158547 -
all0.406 --
Rfree--0 %
obs--100 %
Solvent computationSolvent model: BABINET MODEL
Displacement parametersBiso mean: 81.974 Å2
Baniso -1Baniso -2Baniso -3
1--0.308 Å20.007 Å2-0.001 Å2
2---0.31 Å2-0.005 Å2
3---0.618 Å2
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
ELECTRON MICROSCOPYr_bond_refined_d0.0050.01251240
ELECTRON MICROSCOPYr_angle_refined_deg1.6431.64469576
ELECTRON MICROSCOPYr_dihedral_angle_1_deg6.98456396
ELECTRON MICROSCOPYr_dihedral_angle_2_deg31.54223.5863012
ELECTRON MICROSCOPYr_dihedral_angle_3_deg13.123158484
ELECTRON MICROSCOPYr_dihedral_angle_4_deg18.90815324
ELECTRON MICROSCOPYr_chiral_restr0.1160.26576
ELECTRON MICROSCOPYr_gen_planes_refined0.0080.0239792
ELECTRON MICROSCOPYr_nbd_refined0.1880.237776
ELECTRON MICROSCOPYr_nbtor_refined0.2850.269690
ELECTRON MICROSCOPYr_xyhbond_nbd_refined0.070.22620
ELECTRON MICROSCOPYr_metal_ion_refined0.0070.24
ELECTRON MICROSCOPYr_mcbond_it2.4258.02425692
ELECTRON MICROSCOPYr_mcangle_it4.32412.02332052
ELECTRON MICROSCOPYr_scbond_it3.1138.24325548
ELECTRON MICROSCOPYr_scangle_it5.38412.20237524
ELECTRON MICROSCOPYr_lrange_it10.485147.928197448
LS refinement shell

Refine-ID: ELECTRON MICROSCOPY / Num. reflection Rfree: _ / Total num. of bins used: 20 / % reflection obs: 100 %

Resolution (Å)Rfactor RworkNum. reflection RworkRfactor allNum. reflection allFsc workWRfactor Rwork
2.36-2.4210.6038263580.6038263580.2140.603
2.421-2.4880.598043690.598043690.2470.59
2.488-2.560.5757837080.5757837080.2890.575
2.56-2.6390.5577592690.5577592690.3550.557
2.639-2.7250.5277369350.5277369350.4510.527
2.725-2.8210.5067122810.5067122810.5490.506
2.821-2.9270.4686885300.4686885300.6110.468
2.927-3.0470.4386607950.4386607950.670.438
3.047-3.1820.4066339940.4066339940.7370.406
3.182-3.3380.3786065580.3786065580.7770.378
3.338-3.5180.3535774080.3535774080.8240.353
3.518-3.7310.3485449690.3485449690.8350.348
3.731-3.9890.335124430.335124430.8650.33
3.989-4.3090.334772560.334772560.8690.33
4.309-4.720.354384160.354384160.8530.35
4.72-5.2770.3283968880.3283968880.8590.328
5.277-6.0930.3643500250.3643500250.8070.364
6.093-7.4620.4162950040.4162950040.7510.416
7.462-10.5510.3942282520.3942282520.7590.394
10.551-412.1920.5331250110.5331250110.2240.533

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