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Textilinin-1, a kunitz-type serine protease inhibitor from pichia expression system

Analyse Textilinin-1, a kunitz-type serine protease inhibitor from pichia expression… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5ZJ3
Type
protein
Length
170 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Kunitz-type serine protease inhibitor textilinin-1
UniProt
Q90WA1
Pockets
1 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 21% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CKunitz-type serine protease inhibitor textilinin-1protein5621% helix, 27% strandQ90WA1
BKunitz-type serine protease inhibitor textilinin-1protein5821% helix, 28% strandQ90WA1

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14940.700.8051empty

Interfaces

3 interfaces between chains.

  • A–B · 668 Ų buried · 9 hydrogen bonds · protein-protein
  • A–C · 250 Ų buried · 4 hydrogen bonds · protein-protein
  • B–C · 195 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 9 disulfide (disulfide).

Compared structures

  • 5ZJ3 · Textilinin-1, A Kunitz-Type Serine Protease Inhibitor From pichia expression system · the same entry in another collection · chain A against A, TM-score 1.00
  • Q90WA1 · AlphaFold monomer V2.0 prediction for kunitz-type serine protease inhibitor textilinin-1… · a predicted model of the same protein · chain A against A, TM-score 0.97

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