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Complex of bovine odorant binding protein (obp) with a selenium containing odorant

Analyse Complex of bovine odorant binding protein (obp) with a selenium containing… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1PBO
Type
protein
Length
308 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Odorant binding protein
UniProt
P07435
Ligands
SES
Pockets
4 · best druggability 0.84

Structure

x-ray diffraction · 2 distinct chains · 17% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOdorant binding proteinprotein15718% helix, 47% strandP07435
BOdorant binding proteinprotein15115% helix, 48% strandP07435

Ligands and binding sites

  • SES · 4-butyl-5-propyl-1,3-selenazol-2-amine · ligand · 2 copies · chains A, B

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

Pockets

4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11780.840.9826SES
21760.840.9825SES
32330.770.9128empty
41230.390.7422empty

Interfaces

1 interface between chains.

  • A–B · 2477 Ų buried · 20 hydrogen bonds · protein-protein

Compared structures

  • 1PBO · Complex of bovine odorant binding protein (obp) with a selenium containing odorant · the same entry in another collection · chain A against A, TM-score 1.00
  • P07435 · AlphaFold monomer V2.0 prediction for odorant-binding protein (P07435) · a predicted model of the same protein · chain B against A, TM-score 0.98

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