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MolNFT v1 · #105961 · protein

Identification and characterization of a small molecule inhibitor of S. pyogenes speb.

4RKX · Streptopain: “Identification and characterization of a small molecule inhibitor of S. pyogenes speb.”. X-ray diffraction, 2 ligands (3S9, NO3). MolNFT v1 #105961 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4RKX
Type
protein
Length
254 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Streptopain
EC
3.4.22.10
UniProt
E0PTS8
Ligands
3S9, NO3

Structure

x-ray diffraction · 1 distinct chain · 25% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AStreptopain (EC 3.4.22.10)protein25425% helix, 21% strandE0PTS8

Ligands and binding sites

  • 3S9 · benzyl (cyanomethyl)carbamate · ligand · chains A
  • NO3 · Nitrate ion · ion · chains A

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

Compared structures

  • 4RKX · Identification and characterization of a small molecule inhibitor of S. pyogenes SpeB. · the same entry in another collection · chain A against A, TM-score 1.00

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