GL1X · GenesisL1 explorer

MolNFT v1 · #18181 · protein

2:2 complex of G-csf with its receptor

1PGR · Protein (granulocyte colony-stimulating factor): “2:2 complex of G-csf with its receptor”. X-ray diffraction, 14 pockets (best druggability 0.62). MolNFT v1 #18181 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1PGR
Type
protein
Length
1,471 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (granulocyte colony-stimulating factor); Protein (G-csf receptor)
UniProt
P09919, P40223
Pockets
14 · best druggability 0.62

Structure

x-ray diffraction · 6 distinct chains · 34% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein (granulocyte colony-stimulating factor)protein16169% helix, 1% strandP09919
BProtein (G-csf receptor)protein2086% helix, 46% strandP40223
C, GProtein (granulocyte colony-stimulating factor)protein16569% helix, 0% strandP09919
D, HProtein (G-csf receptor)protein2006% helix, 46% strandP40223
EProtein (granulocyte colony-stimulating factor)protein16368% helix, 1% strandP09919
FProtein (G-csf receptor)protein2096% helix, 45% strandP40223

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1500.620.9415empty
2560.610.9219empty
33400.580.7634empty
42600.550.7733empty
52420.530.7631empty

Interfaces

8 interfaces between chains.

  • E–F · 819 Ų buried · 11 hydrogen bonds · protein-protein
  • G–H · 812 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 803 Ų buried · 10 hydrogen bonds · protein-protein
  • C–D · 785 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 330 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 28 disulfide (disulfide).

Compared structures

  • 1PGR · 2:2 complex of G-csf with its receptor · the same entry in another collection · chain H against H, TM-score 1.00
  • P40223 · AlphaFold monomer V2.0 prediction for granulocyte colony-stimulating factor receptor… · a predicted model of the same protein · chain H against A, TM-score 0.98

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