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Crystal structure of insulin-like growth factor 1 receptor (igf-1R-wt) complex with a carbon-linked proline isostere inhibitor (34)

Analyse Crystal structure of insulin-like growth factor 1 receptor (igf-1R-wt) complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3NW7
Type
protein
Length
297 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Insulin-like growth factor 1 receptor
EC
2.7.10.1
UniProt
P08069
Ligands
LGV
Pockets
5 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInsulin-like growth factor 1 receptor (EC 2.7.10.1)protein29739% helix, 15% strandP08069

Ligands and binding sites

  • LGV · N-({4-[(3-cyclopropyl-1H-pyrazol-5-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl}methyl)-6-fluoropyridine-3-carboxamide · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11800.700.8829LGV
21530.440.7519empty
3990.410.7724empty
4640.310.7514empty
5680.280.7318empty

Compared structures

  • 3NW7 · Crystal structure of insulin-like growth factor 1 receptor (IGF-1R-WT) complex with a… · the same entry in another collection · chain A against A, TM-score 1.00
  • P08069 · AlphaFold monomer V2.0 prediction for insulin-like growth factor 1 receptor (P08069) · a predicted model of the same protein · chain A against A, TM-score 0.94

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