GL1X · GenesisL1 explorer

MolNFT v1 · #104353 · protein

Neutrophil serine protease 4 (PRSS57) apo form 1

4Q7X · Serine protease 57: “Neutrophil serine protease 4 (PRSS57) apo form 1”. X-ray diffraction, 2 ligands (NAG, FUC), 5 pockets (best druggability 0.72). MolNFT v1 #104353 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4Q7X
Type
protein
Length
467 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Serine protease 57
EC
3.4.21.-
UniProt
Q6UWY2
Ligands
NAG, FUC
Pockets
5 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 12% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASerine protease 57 (EC 3.4.21.-)protein23511% helix, 35% strandQ6UWY2
BSerine protease 57 (EC 3.4.21.-)protein23212% helix, 35% strandQ6UWY2

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains A, B
  • FUC · alpha-L-fucopyranose · sugar · 2 copies · chains A, B
  • GOL · Glycerol · additive · 3 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18980.720.7670GOL
2760.330.7416empty
3530.290.7518empty
4610.290.7418empty
5610.290.7419empty

Interfaces

1 interface between chains.

  • A–B · 504 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide, 4 glycan (disulfide, N-glycosylation).

Compared structures

  • 4Q7X · Neutrophil serine protease 4 (PRSS57) apo form 1 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q6UWY2 · AlphaFold monomer V2.0 prediction for serine protease 57 (Q6UWY2) · a predicted model of the same protein · chain B against A, TM-score 1.00

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