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Structure of aedes aegypti OBP22 in the complex with arachidonic acid

Analyse Structure of aedes aegypti OBP22 in the complex with arachidonic acid in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6NBN
Type
protein
Length
123 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
AAEL005772-pa
UniProt
Q1HRL7
Ligands
ACD
Pockets
1 · best druggability 0.79

Structure

solution nmr · 1 distinct chain · 61% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAAEL005772-paprotein12361% helix, 3% strandQ1HRL7

Ligands and binding sites

  • ACD · Arachidonic acid · ligand · chains A

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
12260.790.9233ACD

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 6NBN · Structure of Aedes aegypti OBP22 in the complex with arachidonic acid · the same entry in another collection · chain A against A, TM-score 1.00

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