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Lig V 1 structure and the inflammatory response to the ole E 1 protein family

Analyse Lig V 1 structure and the inflammatory response to the ole E 1 protein family in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6YOA
Type
protein
Length
275 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Major pollen allergen lig V 1
UniProt
O82015
Ligands
NI
Pockets
1 · best druggability 0.83

Structure

x-ray diffraction · 2 distinct chains · 9% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMajor pollen allergen lig V 1protein1387% helix, 44% strandO82015
BMajor pollen allergen lig V 1protein13712% helix, 36% strandO82015

Ligands and binding sites

  • NI · Nickel (II) ion · metal · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15080.830.8950empty

Interfaces

1 interface between chains.

  • A–B · 1679 Ų buried · 24 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 6YOA · Lig v 1 structure and the inflammatory response to the Ole e 1 protein family · the same entry in another collection · chain A against A, TM-score 1.00
  • O82015 · AlphaFold monomer V2.0 prediction for major pollen allergen lig V 1 (O82015) · a predicted model of the same protein · chain A against A, TM-score 0.98

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