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Structure of tPA and PAI-1

Analyse Structure of tPA and PAI-1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5ZLZ
Type
protein
Length
620 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.581
Source
Homo sapiens
Molecule
Plasminogen activator inhibitor 1; Tissue-type plasminogen activator
EC
3.4.21.68
UniProt
P05121, P00750
Pockets
7 · best druggability 0.69

Structure

x-ray diffraction · resolution 3.581 · 2 distinct chains · 19% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
IPlasminogen activator inhibitor 1protein37227% helix, 28% strandP05121
ETissue-type plasminogen activator (EC 3.4.21.68)protein2488% helix, 35% strandP00750

Ligands and binding sites

  • GOL · Glycerol · additive · 2 copies · chains E

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
1900.690.9225empty
2750.670.9323empty
32460.600.8038empty
41650.590.8340empty
52000.490.7629GOL

Interfaces

1 interface between chains.

  • I–E · 1273 Ų buried · 22 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

  • 5ZLZ · Structure of tpa and pai-1 · the same entry in another collection · chain E against E, TM-score 1.00
  • P00750 · AlphaFold monomer V2.0 prediction for tissue-type plasminogen activator (P00750) · a predicted model of the same protein · chain E against A, TM-score 0.98
  • P05121 · AlphaFold monomer V2.0 prediction for plasminogen activator inhibitor 1 (P05121) · a predicted model of the same protein · chain I against A, TM-score 0.96

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