GL1X · GenesisL1 explorer

MolNFT v1 · #28608 · protein

Variable small protein 1 of borrelia turicatae (vspa or VSP1)

1YJG · Surface protein vspa: “Variable small protein 1 of borrelia turicatae (vspa or VSP1)”. X-ray diffraction, 2 pockets (best druggability 0.70). MolNFT v1 #28608 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1YJG
Type
protein
Length
626 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Surface protein vspa
UniProt
O34000
Pockets
2 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 71% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, ESurface protein vspaprotein15771% helix, 5% strandO34000
DSurface protein vspaprotein15571% helix, 5% strandO34000

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16950.700.7876empty
21550.620.8427empty

Interfaces

5 interfaces between chains.

  • A–B · 1959 Ų buried · 17 hydrogen bonds · protein-protein
  • D–E · 1939 Ų buried · 17 hydrogen bonds · protein-protein
  • B–D · 309 Ų buried · 1 hydrogen bond · protein-protein
  • B–E · 70 Ų buried · 1 hydrogen bond · protein-protein
  • A–D · 66 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 1YJG · Variable Small Protein 1 of Borrelia turicatae (VspA or Vsp1) · the same entry in another collection · chain A against A, TM-score 1.00

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