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MolNFT v1 · #136031 · protein

Zinc-binding structure of a catalytic amyloid from solid-state NMR spectroscopy

5UGK · Ile-his-val-his-leu-gln-ile: “Zinc-binding structure of a catalytic amyloid from solid-state NMR spectroscopy”. Solid-state nmr, 1 ligand (ZN). MolNFT v1 #136031 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5UGK
Type
protein
Length
84 residues
Chains
12
Method
solid-state nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ile-his-val-his-leu-gln-ile
Ligands
ZN

Structure

solid-state nmr · 1 distinct chain · 0% helix, 71% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, G, I, K, O, Q, S, U, W, YIle-his-val-his-leu-gln-ileprotein70% helix, 71% strand—

Ligands and binding sites

  • ZN · Zinc ion · metal · 12 copies · chains A, C, E, G, I, K, O, Q, S, U, W, Y

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

Interfaces

26 interfaces between chains.

  • I–K · 347 Ų buried · 11 hydrogen bonds · protein-protein
  • S–U · 344 Ų buried · 11 hydrogen bonds · protein-protein
  • W–Y · 344 Ų buried · 11 hydrogen bonds · protein-protein
  • E–G · 342 Ų buried · 9 hydrogen bonds · protein-protein
  • A–C · 342 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 5UGK · Zinc-Binding Structure of a Catalytic Amyloid from Solid-State NMR Spectroscopy · the same entry in another collection · chain O against O, TM-score 1.00

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