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Envelope glycprotein of endogenous retrovirus Y032 (atlas virus) from the human hookworm ancylostoma ceylanicum

Analyse Envelope glycprotein of endogenous retrovirus Y032 (atlas virus) from the human… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7A4A
Type
protein
Length
1,317 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Integrase catalytic domain-containing protein
UniProt
A0A016UZK2
Ligands
NAG
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 1 distinct chain · 3% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CIntegrase catalytic domain-containing proteinprotein4393% helix, 44% strandA0A016UZK2

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 3 copies · chains A, B, C

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

Pockets

20 pockets found on a 1 Å grid, 15 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17980.870.89103empty
27350.840.8776empty
31470.800.9733empty
41780.790.9433empty
5970.770.9821empty

Interfaces

3 interfaces between chains.

  • A–C · 3201 Ų buried · 30 hydrogen bonds · protein-protein
  • A–B · 3186 Ų buried · 31 hydrogen bonds · protein-protein
  • B–C · 3186 Ų buried · 29 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 45 disulfide, 3 glycan (disulfide, N-glycosylation).

Compared structures

  • 7A4A · Envelope glycprotein of endogenous retrovirus Y032 (Atlas virus) from the human hookworm… · the same entry in another collection · chain A against A, TM-score 1.00

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