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Structure of a redesigned cross-reactive antibody to dengue virus with increased in vivo potency

Analyse Structure of a redesigned cross-reactive antibody to dengue virus with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5AAM
Type
protein
Length
646 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SCFV513; Envelope protein
UniProt
U3N5N6
Pockets
1 · best druggability 0.77

Structure

x-ray diffraction · 4 distinct chains · 2% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASCFV513protein2283% helix, 49% strand—
BSCFV513protein2273% helix, 49% strand—
CEnvelope proteinprotein950% helix, 36% strandU3N5N6
JEnvelope proteinprotein960% helix, 43% strandU3N5N6

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111980.770.79125empty

Interfaces

4 interfaces between chains.

  • B–J · 1090 Ų buried · 20 hydrogen bonds · protein-protein
  • A–C · 1073 Ų buried · 22 hydrogen bonds · protein-protein
  • A–B · 570 Ų buried · 2 hydrogen bonds · protein-protein
  • A–J · 73 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 5AAM · Structure of a redesigned cross-reactive antibody to dengue virus with increased in vivo… · the same entry in another collection · chain A against A, TM-score 1.00

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