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Structure of human islet amyloid polypeptide in complex with an engineered binding protein

Analyse Structure of human islet amyloid polypeptide in complex with an engineered… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5K5G
Type
protein
Length
109 residues
Chains
3
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Islet amyloid polypeptide; HI18
UniProt
P10997
Pockets
1 · best druggability 0.51

Structure

solution nmr · 2 distinct chains · 46% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIslet amyloid polypeptideprotein210% helix, 62% strandP10997
B, CHI18protein4468% helix, 7% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11010.510.8218empty

Interfaces

3 interfaces between chains.

  • A–C · 659 Ų buried · 9 hydrogen bonds · protein-protein
  • A–B · 558 Ų buried · 8 hydrogen bonds · protein-protein
  • B–C · 378 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 5K5G · Structure of human islet amyloid polypeptide in complex with an engineered binding protein · the same entry in another collection · chain A against A, TM-score 1.00
  • P10997 · AlphaFold monomer V2.0 prediction for islet amyloid polypeptide (P10997) · a predicted model of the same protein · chain A against A, TM-score 0.18

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