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Structure of human dppiii in complex with the opioid peptide tynorphin, at 3.0 ångströms

Analyse Structure of human dppiii in complex with the opioid peptide tynorphin, at 3.0… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3T6J
Type
protein
Length
727 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dipeptidyl peptidase 3; Tynorphin
EC
3.4.14.4
UniProt
Q9NY33
Pockets
6 · best druggability 0.85

Structure

x-ray diffraction · 2 distinct chains · 48% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADipeptidyl peptidase 3 (EC 3.4.14.4)protein72248% helix, 14% strandQ9NY33
BTynorphinprotein50% helix, 40% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111760.850.86121empty
21180.770.9627empty
32810.670.8237empty
41300.520.8132empty
5620.330.7616empty

Interfaces

1 interface between chains.

  • A–B · 695 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 3T6J · Structure of human DPPIII in complex with the opioid peptide Tynorphin, at 3.0 Angstroms · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9NY33 · AlphaFold monomer V2.0 prediction for dipeptidyl peptidase 3 (Q9NY33) · a predicted model of the same protein · chain A against A, TM-score 1.00

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