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MolNFT v1 · #59268 · protein

Structure of urokinase receptor, urokinase and vitronectin complex

3BT1 · Urokinase-type plasminogen activator: “Structure of urokinase receptor, urokinase and vitronectin complex”. X-ray diffraction, 2 ligands (NAG, MAN), 7 pockets (best druggability 0.58). MolNFT v1 #59268 on GenesisL1: 3D structure…

PDB
3BT1
Type
protein
Length
438 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Urokinase-type plasminogen activator; Vitronectin; Urokinase plasminogen activator…
UniProt
P00749, P04004, Q03405
Ligands
NAG, MAN
Pockets
7 · best druggability 0.58

Structure

x-ray diffraction · 3 distinct chains · 6% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUrokinase-type plasminogen activatorprotein1256% helix, 23% strandP00749
BVitronectinprotein4020% helix, 5% strandP04004
UUrokinase plasminogen activator surface receptorprotein2734% helix, 47% strandQ03405

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains U
  • MAN · alpha-D-mannopyranose · sugar

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1840.580.8826empty
22680.570.7839empty
33040.550.7647empty
41670.530.7929empty
5600.420.8217empty

Interfaces

2 interfaces between chains.

  • A–U · 1364 Ų buried · 16 hydrogen bonds · protein-protein
  • B–U · 660 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 26 disulfide, 3 glycan (disulfide, N-glycosylation).

Compared structures

  • 3BT1 · Structure of urokinase receptor, urokinase and vitronectin complex · 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 U against A, TM-score 0.97
  • P04004 · AlphaFold monomer V2.0 prediction for vitronectin (P04004) · a predicted model of the same protein · chain B against A, TM-score 0.79

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