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MolNFT v1 · #176900 · protein

Structure of dimeric upar

7E17 · Urokinase plasminogen activator surface receptor: “Structure of dimeric upar”. X-ray diffraction, 1 ligand (NAG), 8 pockets (best druggability 0.62). MolNFT v1 #176900 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7E17
Type
protein
Length
457 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Urokinase plasminogen activator surface receptor
UniProt
Q03405
Ligands
NAG
Pockets
8 · best druggability 0.62

Structure

x-ray diffraction · 2 distinct chains · 9% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUrokinase plasminogen activator surface receptorprotein2259% helix, 44% strandQ03405
BUrokinase plasminogen activator surface receptorprotein2328% helix, 42% strandQ03405

Ligands and binding sites

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

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

Pockets

8 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12950.620.7950empty
21760.610.8330empty
34650.600.7556empty
42950.590.7841empty
5780.450.8118empty

Interfaces

1 interface between chains.

  • A–B · 3985 Ų buried · 84 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 25 disulfide, 6 glycan (disulfide, N-glycosylation).

Compared structures

  • 7E17 · Structure of dimeric uPAR · the same entry in another collection · chain A against A, TM-score 1.00
  • Q03405 · AlphaFold monomer V2.0 prediction for urokinase plasminogen activator surface receptor… · a predicted model of the same protein · chain A against A, TM-score 0.60

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