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MolNFT v1 · #135946 · protein

Prommp-7 with heparin octasaccharide bound to the catalytic domain

5UE5 · Matrilysin: “Prommp-7 with heparin octasaccharide bound to the catalytic domain”. Solution nmr, 4 ligands (SGN, IDS, CA), 2 pockets (best druggability 0.49). MolNFT v1 #135946 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5UE5
Type
protein
Length
247 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Matrilysin
EC
3.4.24.23
UniProt
P09237
Ligands
SGN, IDS, CA, ZN
Pockets
2 · best druggability 0.49

Structure

solution nmr · 1 distinct chain · 34% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMatrilysin (EC 3.4.24.23)protein24734% helix, 9% strandP09237

Ligands and binding sites

  • SGN · 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose · sugar · 4 copies · chains A
  • IDS · 2-O-sulfo-alpha-L-idopyranuronic acid · sugar · 4 copies · chains A
  • CA · Calcium ion · metal · 2 copies · chains A
  • ZN · Zinc ion · metal · 2 copies · chains A

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12410.490.7431empty
2510.440.8311empty

Compared structures

  • 5UE5 · proMMP-7 with heparin octasaccharide bound to the catalytic domain · the same entry in another collection · chain A against A, TM-score 1.00
  • P09237 · AlphaFold monomer V2.0 prediction for matrilysin (P09237) · a predicted model of the same protein · chain A against A, TM-score 0.82

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