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MolNFT v1 · #112987 · protein

Cryo-EM structure of dengue virus serotype 2 strain PVP94-07 complexed with human antibody 2D22 Fab at 37 degrees C

5A1Z · Envelope protein: “Cryo-EM structure of dengue virus serotype 2 strain PVP94-07 complexed with human antibody 2D22 Fab at 37…”. Electron microscopy, 5 pockets (best druggability 0.43). MolNFT v1 #112987 on GenesisL1: 3D structure…

PDB
5A1Z
Type
protein
Length
2,394 residues
Chains
12
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Envelope protein; Membrane glycoprotein; Antigen-binding fragment of human antibody 2D22…
UniProt
G9FRP5, V5TI05
Pockets
5 · best druggability 0.43

Structure

electron microscopy · 4 distinct chains · 0% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, EEnvelope proteinprotein4950% helix, 0% strandG9FRP5
B, D, FMembrane glycoproteinprotein720% helix, 0% strandV5TI05
G, I, KAntigen-binding fragment of human antibody 2D22 - heavy chainprotein1200% helix, 0% strand—
H, J, LAntigen-binding fragment of human antibody 2D22 - light chainprotein1110% helix, 0% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11450.430.7335empty
2880.350.7328empty
3660.320.7320empty
4760.320.7222empty
5510.270.7220empty

Interfaces

19 interfaces between chains.

  • E–F · 267 Ų buried · 0 hydrogen bonds · protein-protein
  • C–D · 255 Ų buried · 0 hydrogen bonds · protein-protein
  • A–B · 248 Ų buried · 0 hydrogen bonds · protein-protein
  • C–E · 235 Ų buried · 0 hydrogen bonds · protein-protein
  • A–C · 194 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 5A1Z · Cryo-EM structure of Dengue virus serotype 2 strain PVP94-07 complexed with human… · the same entry in another collection · chain J against J, TM-score 1.00

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