BMRB Entry 34652

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PDB ID: 7p5q
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR34652
MolProbity Validation Chart

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Title:
NMR structure of a peptide deriving from SARS-CoV-2 Lineage B.1.1.7 S RBD 482-506 fragment in HFIP/H2O
Deposition date:
2021-07-14
Original release date:
2022-07-21
Authors:
Santoro, A.; Buonocore, M.; Grimaldi, M.; D'Ursi, A.M.
Citation:

Citation: Buonocore, Michela; Santoro, Angelo; Grimaldi, Manuela; Covelli, Verdiana; Firoznezhad, Mohammad; Rodriquez, Manuela; Santin, Matteo; D'Ursi, Anna Maria. "Structural analysis of a simplified model reproducing SARS-CoV-2 S RBD/ACE2 binding site"  Heliyon 8, e11568-e11568 (2022).
PubMed: 36406731

Assembly members:

Assembly members:
entity_1, polymer, 25 residues, 2822.067 Da.

Natural source:

Natural source:   Common Name: SARS-CoV-2   Taxonomy ID: 2697049   Superkingdom: Viruses   Kingdom: not available   Genus/species: Betacoronavirus HCoV-SARS

Experimental source:

Experimental source:   Production method: chemical synthesis

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: GVEGFNCYFPLQSYGFQPTY GVGYQ

Data sets:
Data typeCount
13C chemical shifts52
1H chemical shifts144

Additional metadata:

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Assembly:

Entity Assembly IDEntity NameEntity ID
1unit_11

Entities:

Entity 1, unit_1 25 residues - 2822.067 Da.

1   GLYVALGLUGLYPHEASNCYSTYRPHEPRO
2   LEUGLNSERTYRGLYPHEGLNPROTHRTYR
3   GLYVALGLYTYRGLN