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MolNFT v1 · #167611 · protein

Crystal structure of epiphyas postvittana pheromone binding protein 3

6VQ5 · Pheromome binding protein: “Crystal structure of epiphyas postvittana pheromone binding protein 3”. X-ray diffraction, 1 pocket (best druggability 0.86). MolNFT v1 #167611 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6VQ5
Type
protein
Length
230 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pheromome binding protein
UniProt
A0A0K8TU48
Pockets
1 · best druggability 0.86

Structure

x-ray diffraction · 2 distinct chains · 66% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APheromome binding proteinprotein11367% helix, 0% strandA0A0K8TU48
BPheromome binding proteinprotein11765% helix, 2% strandA0A0K8TU48

Ligands and binding sites

  • PG0 · 2-(2-methoxyethoxy)ethanol · additive · 2 copies · chains A, 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
111890.860.8673PG0

Interfaces

1 interface between chains.

  • A–B · 508 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 6VQ5 · Crystal Structure of Epiphyas postvittana Pheromone Binding Protein 3 · the same entry in another collection · chain A against A, TM-score 1.00

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