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Cryo-EM structure of mature coxsackievirus A10 in complex with KRM1 at pH 5.5

Analyse Cryo-EM structure of mature coxsackievirus A10 in complex with KRM1 at pH 5.5 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7BZU
Type
protein
Length
1,093 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein VP1; Capsid protein VP2; Capsid protein VP3; Capsid protein VP4; KRM1
UniProt
G0YPI2
Ligands
NAG
Pockets
16 · best druggability 0.78

Structure

electron microscopy · 5 distinct chains · 8% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACapsid protein VP1protein2728% helix, 26% strand—
BCapsid protein VP2protein2469% helix, 33% strandG0YPI2
CCapsid protein VP3protein23911% helix, 31% strandG0YPI2
DCapsid protein VP4protein439% helix, 2% strandG0YPI2
EKRM1protein2933% helix, 28% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 3 copies · chains E

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

16 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13030.780.8955empty
21310.710.9128empty
3550.690.9730empty
46720.670.7686empty
51460.540.8123empty

Interfaces

9 interfaces between chains.

  • A–C · 3724 Ų buried · 42 hydrogen bonds · protein-protein
  • A–B · 2289 Ų buried · 34 hydrogen bonds · protein-protein
  • B–C · 1733 Ų buried · 14 hydrogen bonds · protein-protein
  • A–D · 1018 Ų buried · 11 hydrogen bonds · protein-protein
  • C–D · 844 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide, 3 glycan (disulfide, N-glycosylation).

Compared structures

  • 7BZU · Cryo-EM structure of mature Coxsackievirus A10 in complex with KRM1 at pH 5.5 · the same entry in another collection · chain A against A, TM-score 1.00

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