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The structure of the insect olfactory receptor OR5 from machilis hrabei in complex with deet

Analyse The structure of the insect olfactory receptor OR5 from machilis hrabei in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7LIG
Type
protein
Length
1,524 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MHOR5
Ligands
DE3
Pockets
20 · best druggability 0.79

Structure

electron microscopy · 1 distinct chain · 76% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DMHOR5protein38176% helix, 1% strand—

Ligands and binding sites

  • DE3 · N,N-diethyl-3-methylbenzamide · ligand · 4 copies · chains A, B, C, D

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

Pockets

20 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11300.790.9616DE3
21330.780.9618DE3
31330.780.9520DE3
41290.770.9518DE3
52340.770.9138empty

Interfaces

6 interfaces between chains.

  • A–D · 1287 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 1283 Ų buried · 6 hydrogen bonds · protein-protein
  • C–D · 1269 Ų buried · 7 hydrogen bonds · protein-protein
  • B–C · 1259 Ų buried · 5 hydrogen bonds · protein-protein
  • A–C · 16 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7LIG · The structure of the insect olfactory receptor OR5 from Machilis hrabei in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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