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MolNFT v1 · #175852 · protein

Foot and mouth disease virus O/TIBET/99-bound the single chain fragmen antibody F145

7D3L · O/TIBET/99 VP1: “Foot and mouth disease virus O/TIBET/99-bound the single chain fragmen antibody F145”. Electron microscopy, 7 pockets (best druggability 0.75). MolNFT v1 #175852 on GenesisL1: 3D structure, binding sites and pockets…

PDB
7D3L
Type
protein
Length
898 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
O/TIBET/99 VP1; O/TIBET/99 VP2; O/TIBET/99 VP3; O/TIBET/99 VP4; F145 vh; F145 vl
Pockets
7 · best druggability 0.75

Structure

electron microscopy · 6 distinct chains · 6% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
1O/TIBET/99 VP1protein1834% helix, 25% strand—
2O/TIBET/99 VP2protein2064% helix, 37% strand—
3O/TIBET/99 VP3protein2199% helix, 26% strand—
4O/TIBET/99 VP4protein4524% helix, 0% strand—
HF145 vhprotein1374% helix, 25% strand—
LF145 vlprotein1083% helix, 43% strand—

Pockets

7 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18480.750.7973empty
25710.700.7954empty
31430.430.7526empty
41100.410.7723empty
51130.400.7520empty

Interfaces

8 interfaces between chains.

  • H–L · 1267 Ų buried · 25 hydrogen bonds · protein-protein
  • 1–2 · 1260 Ų buried · 20 hydrogen bonds · protein-protein
  • 1–3 · 1053 Ų buried · 13 hydrogen bonds · protein-protein
  • 2–3 · 890 Ų buried · 12 hydrogen bonds · protein-protein
  • 1–4 · 828 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 7D3L · Foot and mouth disease virus O/TIBET/99-bound the single chain fragmen antibody F145 · the same entry in another collection · chain 1 against 1, TM-score 1.00

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