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- EMDB-36892: Structure of BtKY72 spike receptor-binding domain (RBD) complexed... -

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Basic information

Entry
Database: EMDB / ID: EMD-36892
TitleStructure of BtKY72 spike receptor-binding domain (RBD) complexed with bat ACE2
Map data
Sample
  • Complex: Structure of BtKY72 spike receptor-binding domain (RBD) complexed with bat ACE2
    • Complex: BtKY72 RBD
      • Protein or peptide: BtKY72
    • Complex: Bat ACE2
      • Protein or peptide: ACE2
  • Ligand: ZINC ION
KeywordsBtKY72 RBD ACE2 bat / VIRAL PROTEIN
Biological speciesSevere acute respiratory syndrome-related coronavirus / Rhinolophus landeri (Lander's horseshoe bat)
Methodsingle particle reconstruction / cryo EM / Resolution: 3.2 Å
AuthorsSu C / Qi JX / Gao GF
Funding support1 items
OrganizationGrant numberCountry
Not funded
CitationJournal: To Be Published
Title: Structural characteristics of BtKY72 RBD bound to bat ACE2 reveal multiple key residues affecting ACE2 usage of sarbecoviruses
Authors: Su C / He JH / Qi JX / Yang MS / Wang QH / Gao GF
History
DepositionJul 20, 2023-
Header (metadata) releaseJun 19, 2024-
Map releaseJun 19, 2024-
UpdateJun 19, 2024-
Current statusJun 19, 2024Processing site: PDBj / Status: Released

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Structure visualization

Supplemental images

Downloads & links

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Map

FileDownload / File: emd_36892.map.gz / Format: CCP4 / Size: 178 MB / Type: IMAGE STORED AS FLOATING POINT NUMBER (4 BYTES)
Projections & slices

Image control

Size
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AxesZ (Sec.)Y (Row.)X (Col.)
0.67 Å/pix.
x 360 pix.
= 240.84 Å
0.67 Å/pix.
x 360 pix.
= 240.84 Å
0.67 Å/pix.
x 360 pix.
= 240.84 Å

Surface

Projections

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Images are generated by Spider.

Voxel sizeX=Y=Z: 0.669 Å
Density
Contour LevelBy AUTHOR: 0.114
Minimum - Maximum-1.8936305 - 2.5587635
Average (Standard dev.)-0.0004939009 (±0.049469)
SymmetrySpace group: 1
Details

EMDB XML:

Map geometry
Axis orderXYZ
Origin000
Dimensions360360360
Spacing360360360
CellA=B=C: 240.84001 Å
α=β=γ: 90.0 °

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Supplemental data

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Half map: #1

Fileemd_36892_half_map_1.map
Projections & Slices
AxesZYX

Projections

Slices (1/2)
Density Histograms

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Half map: #2

Fileemd_36892_half_map_2.map
Projections & Slices
AxesZYX

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Slices (1/2)
Density Histograms

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Sample components

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Entire : Structure of BtKY72 spike receptor-binding domain (RBD) complexed...

EntireName: Structure of BtKY72 spike receptor-binding domain (RBD) complexed with bat ACE2
Components
  • Complex: Structure of BtKY72 spike receptor-binding domain (RBD) complexed with bat ACE2
    • Complex: BtKY72 RBD
      • Protein or peptide: BtKY72
    • Complex: Bat ACE2
      • Protein or peptide: ACE2
  • Ligand: ZINC ION

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Supramolecule #1: Structure of BtKY72 spike receptor-binding domain (RBD) complexed...

SupramoleculeName: Structure of BtKY72 spike receptor-binding domain (RBD) complexed with bat ACE2
type: complex / ID: 1 / Parent: 0 / Macromolecule list: #1-#2
Source (natural)Organism: Severe acute respiratory syndrome-related coronavirus

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Supramolecule #2: BtKY72 RBD

SupramoleculeName: BtKY72 RBD / type: complex / ID: 2 / Parent: 1 / Macromolecule list: #1
Source (natural)Organism: Rhinolophus landeri (Lander's horseshoe bat)

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Supramolecule #3: Bat ACE2

SupramoleculeName: Bat ACE2 / type: complex / ID: 3 / Parent: 1 / Macromolecule list: #2

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Macromolecule #1: BtKY72

MacromoleculeName: BtKY72 / type: protein_or_peptide / ID: 1 / Number of copies: 1 / Enantiomer: LEVO
Source (natural)Organism: Severe acute respiratory syndrome-related coronavirus
Molecular weightTheoretical: 25.514703 KDa
Recombinant expressionOrganism: Homo sapiens (human)
SequenceString: RVSPSTEVVR FPNITNLCPF GQVFNASNFP SVYAWERLRI SDCVADYAVL YNSSSSFSTF KCYGVSPTKL NDLCFSSVYA DYFVVKGDD VRQIAPAQTG VIADYNYKLP DDFTGCVLAW NTNSVDSKSG NNFYYRLFRH GKIKPYERDI SNVLYNSAGG T CSSISQLG ...String:
RVSPSTEVVR FPNITNLCPF GQVFNASNFP SVYAWERLRI SDCVADYAVL YNSSSSFSTF KCYGVSPTKL NDLCFSSVYA DYFVVKGDD VRQIAPAQTG VIADYNYKLP DDFTGCVLAW NTNSVDSKSG NNFYYRLFRH GKIKPYERDI SNVLYNSAGG T CSSISQLG CYEPLKSYGF TPTVGVGYQP YRVVVLSFEL LNAPATVCGP KKSTELVKNK CVNFHHHHHH

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Macromolecule #2: ACE2

MacromoleculeName: ACE2 / type: protein_or_peptide / ID: 2 / Number of copies: 1 / Enantiomer: LEVO
Source (natural)Organism: Rhinolophus landeri (Lander's horseshoe bat)
Molecular weightTheoretical: 69.443156 KDa
Recombinant expressionOrganism: Escherichia coli 'BL21-Gold(DE3)pLysS AG' (bacteria)
SequenceString: STPEDLAKTF LDDFNSAAEN LSYQSSLASW EYNTNISDEN IQKMDEAGAK WSDFYETQSK HAKNFSLEEI HNDTVKLQLQ ILQQSGSPV LSEDKSKRLN SILNAMSTIY STGKVCRPNN PQECLLLEPG LDNIMGTSKD YNERLWAWEG WRAEVGKQLR P LYEEYVVL ...String:
STPEDLAKTF LDDFNSAAEN LSYQSSLASW EYNTNISDEN IQKMDEAGAK WSDFYETQSK HAKNFSLEEI HNDTVKLQLQ ILQQSGSPV LSEDKSKRLN SILNAMSTIY STGKVCRPNN PQECLLLEPG LDNIMGTSKD YNERLWAWEG WRAEVGKQLR P LYEEYVVL KNEMARGYHY EDYGDYWRRD YETEGSPDLE YSRDQLTKDV ERIFAEIKPL YEQLHAYVRA KLMDTYPFHI SP TGCLPAH LLGDMWGRFW TNLYPLTVPF GQKPNIDVTD AMLNQTWDAK RIFKEAEKFF VSIGLPHMTE GFWNNSMLTD PGD GRKVVC HPTAWDLGKG DFRIKMCTKV TMEDFLTAHH EMGHIQYDMA YASQPYLLRN GANEGFHEAV GEVMSLSVAT PKHL KTMGL LSPDFLEDNE TEINFLFKQA LTIVGTLPFT YMLEKWRWMV FKGEIPKEEW MTKWWEMKRK IVGVVEPVPH DETYC DPAS LFHVANDYSF IRYYTRTIFE FQFHEALCRI AKHDGPLHKC DISNSTDAGK KLHQMLSVGK SQPWTSVLKD FVDSKD MDV GPLLRYFEPL YTWLKEQNRN SFVGWNTDWS PHAD

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Macromolecule #3: ZINC ION

MacromoleculeName: ZINC ION / type: ligand / ID: 3 / Number of copies: 1 / Formula: ZN
Molecular weightTheoretical: 65.409 Da

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Experimental details

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Structure determination

Methodcryo EM
Processingsingle particle reconstruction
Aggregation stateparticle

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Sample preparation

BufferpH: 8
VitrificationCryogen name: ETHANE

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Electron microscopy

MicroscopeFEI TITAN KRIOS
Image recordingFilm or detector model: GATAN K3 (6k x 4k) / Average electron dose: 50.0 e/Å2
Electron beamAcceleration voltage: 300 kV / Electron source: FIELD EMISSION GUN
Electron opticsIllumination mode: FLOOD BEAM / Imaging mode: BRIGHT FIELD / Nominal defocus max: 2.0 µm / Nominal defocus min: 1.0 µm
Experimental equipment
Model: Titan Krios / Image courtesy: FEI Company

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Image processing

Startup modelType of model: PDB ENTRY
PDB model - PDB ID:
Final reconstructionResolution.type: BY AUTHOR / Resolution: 3.2 Å / Resolution method: FSC 0.143 CUT-OFF / Number images used: 1397414
Initial angle assignmentType: MAXIMUM LIKELIHOOD
Final angle assignmentType: MAXIMUM LIKELIHOOD

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