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Structure of pheromone-binding protein 1 in complex with (Z,Z)-11,13- hexadecadienol

Analyse Structure of pheromone-binding protein 1 in complex with (Z,Z)-11,13… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4INX
Type
protein
Length
140 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pheromone-binding protein 1
UniProt
D0E9M1
Ligands
1EX
Pockets
1 · best druggability 0.84

Structure

x-ray diffraction · 1 distinct chain · 61% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APheromone-binding protein 1protein14061% helix, 1% strandD0E9M1

Ligands and binding sites

  • 1EX · (11Z,13Z)-hexadeca-11,13-dien-1-ol · 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
12500.840.96331EX

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 4INX · Structure of Pheromone-binding protein 1 in complex with (Z,Z)-11,13- hexadecadienol · the same entry in another collection · chain A against A, TM-score 1.00

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