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MolNFT v1 · #153623 · protein

Cryo-EM structure of the full-length human igf-1R in complex with insulin

6JK8 · Insulin-like growth factor 1 receptor: “Cryo-EM structure of the full-length human igf-1R in complex with insulin”. Electron microscopy, 2 ligands (NAG, MAN), 20 pockets (best druggability 0.85). MolNFT v1 #153623 on GenesisL1: 3D…

PDB
6JK8
Type
protein
Length
1,670 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Insulin-like growth factor 1 receptor; Insulin
EC
2.7.10.1
UniProt
P08069, P01308
Ligands
NAG, MAN
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 4 distinct chains · 8% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInsulin-like growth factor 1 receptor (EC 2.7.10.1)protein8238% helix, 30% strandP08069
BInsulin-like growth factor 1 receptor (EC 2.7.10.1)protein8018% helix, 30% strandP08069
CInsulinprotein2138% helix, 0% strandP01308
DInsulinprotein2520% helix, 0% strandP01308

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 16 copies · chains A, B
  • MAN · alpha-D-mannopyranose · sugar · 2 copies · chains A

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

Pockets

20 pockets found on a 1 Å grid, 17 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13890.850.9358empty
21340.800.9735empty
311370.790.8186empty
48250.770.8187empty
51520.760.9343empty

Interfaces

6 interfaces between chains.

  • A–B · 1341 Ų buried · 14 hydrogen bonds · protein-protein
  • C–D · 561 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 540 Ų buried · 4 hydrogen bonds · protein-protein
  • B–D · 455 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 353 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 34 disulfide, 10 glycan (disulfide, N-glycosylation).

Compared structures

  • 6JK8 · Cryo-EM structure of the full-length human IGF-1R in complex with insulin · the same entry in another collection · chain A against A, TM-score 1.00

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