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MolNFT v1 · #107717 · protein

Cryo-EM structure of dengue virus serotype 2 strain new guinea-C complexed with human antibody 2D22 Fab at 37 degree C. the Fab molecules were added to the virus before 37 degree C incubation.

4UIH · Dengue virus serotype 2 strain new guinea-C E protein…: “Cryo-EM structure of dengue virus serotype 2 strain new guinea-C complexed with human antibody 2D22 Fab at 37…”. Electron microscopy, 1 pocket (best druggability 0.36). MolNFT…

PDB
4UIH
Type
protein
Length
1,647 residues
Chains
7
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dengue virus serotype 2 strain new guinea-C E protein ectodomain; Antigen-binding…
EC
3.4.21.91, 3.6.1.15, 3.6.4.13, 2.1.1.56, 2.1.1.57, 2.7.7.48
UniProt
P14340
Pockets
1 · best druggability 0.36

Structure

electron microscopy · 3 distinct chains · 0% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CDengue virus serotype 2 strain new guinea-C E protein ectodomain (EC 3.4.21.91, 3.6.1.15, 3.6.4.13, 2.1.1.56, 2.1.1.57, 2.7.7.48)protein3950% helix, 0% strandP14340
D, FAntigen-binding fragment of human antibody 2D22 -heavy chainprotein1200% helix, 0% strand—
E, GAntigen-binding fragment of human antibody 2D22 -light chainprotein1110% helix, 0% strand—

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1940.360.7331empty

Interfaces

8 interfaces between chains.

  • A–C · 231 Ų buried · 0 hydrogen bonds · protein-protein
  • C–F · 155 Ų buried · 0 hydrogen bonds · protein-protein
  • A–B · 135 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 134 Ų buried · 0 hydrogen bonds · protein-protein
  • D–E · 59 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 4UIH · Cryo-EM structure of Dengue virus serotype 2 strain New Guinea-C complexed with human… · the same entry in another collection · chain F against F, TM-score 1.00

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