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MolNFT v1 · #190285 · protein

Structure of human IGF1/IGFBP3/ALS ternary complex

7WRQ · Insulin-like growth factor-binding protein complex acid…: “Structure of human IGF1/IGFBP3/ALS ternary complex”. Electron microscopy, 2 ligands (NAG, BMA), 13 pockets (best druggability 0.79). MolNFT v1 #190285 on GenesisL1: 3D…

PDB
7WRQ
Type
protein
Length
798 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Insulin-like growth factor-binding protein complex acid labile subunit; Insulin-like…
UniProt
P35858, P17936, P05019
Ligands
NAG, BMA
Pockets
13 · best druggability 0.79

Structure

electron microscopy · 3 distinct chains · 7% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInsulin-like growth factor-binding protein complex acid labile subunitprotein5662% helix, 9% strandP35858
BInsulin-like growth factor-binding protein 3protein16712% helix, 16% strandP17936
CIsoform 3 of insulin-like growth factor Iprotein6534% helix, 3% strandP05019

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, B
  • BMA · beta-D-mannopyranose · sugar

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111660.790.8192empty
27490.700.7771empty
3970.660.9027empty
42370.550.7733empty
5690.520.8518empty

Interfaces

3 interfaces between chains.

  • A–B · 1575 Ų buried · 8 hydrogen bonds · protein-protein
  • B–C · 1429 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 623 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 18 disulfide, 5 glycan (disulfide, N-glycosylation).

Compared structures

  • 7WRQ · Structure of Human IGF1/IGFBP3/ALS Ternary Complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P35858 · AlphaFold monomer V2.0 prediction for insulin-like growth factor- binding protein complex… · a predicted model of the same protein · chain A against A, TM-score 0.89
  • P05019 · AlphaFold monomer V2.0 prediction for insulin-like growth factor I (P05019) · a predicted model of the same protein · chain C against A, TM-score 0.74
  • P17936 · AlphaFold monomer V2.0 prediction for insulin-like growth factor- binding protein 3… · a predicted model of the same protein · chain B against A, TM-score 0.70

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