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Crystal structure of somatostatin receptor 2 (SSTR2) with peptide antagonist CYN 154806

Analyse Crystal structure of somatostatin receptor 2 (SSTR2) with peptide antagonist… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7XNA
Type
protein
Length
480 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.65
Source
Homo sapiens; Niallia circulans; SYNTHETIC CONSTRUCT
Molecule
Somatostatin receptor type 2,Endo-1,4-beta-xylanase; Cyn 154806
EC
3.2.1.8
UniProt
P30874, P09850
Pockets
6 · best druggability 0.56

Structure

x-ray diffraction · resolution 2.65 · 2 distinct chains · 47% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASomatostatin receptor type 2,Endo-1,4-beta-xylanase (EC 3.2.1.8)protein47248% helix, 27% strandP30874, P09850
BCyn 154806protein80% helix, 0% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11480.560.8124empty
21890.470.7526empty
3800.370.7719empty
4750.320.7417empty
5570.290.7415empty

Interfaces

1 interface between chains.

  • A–B · 849 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 3 d-amino, 2 disulfide, 1 modified (D-amino acid, disulfide, nonstandard).

Compared structures

  • 7XNA · Crystal structure of somatostatin receptor 2 (SSTR2) with peptide antagonist cyn 154806 · the same entry in another collection · chain A against A, TM-score 1.00
  • P30874 · AlphaFold monomer V2.0 prediction for somatostatin receptor type 2 (P30874) · a predicted model of the same protein · chain A against A, TM-score 0.60
  • P09850 · AlphaFold monomer V2.0 prediction for endo-1,4-beta-xylanase (P09850) · a predicted model of the same protein · chain A against A, TM-score 0.39

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