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MolNFT v1 · #128104 · protein

Lybatide 2, a cystine-rich peptide from lycium barbarum

5NGN: “Lybatide 2, a cystine-rich peptide from lycium barbarum”. X-ray diffraction, 1 ligand (CCN). MolNFT v1 #128104 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5NGN
Type
protein
Length
98 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lybatide 2
Ligands
CCN

Structure

x-ray diffraction · 2 distinct chains · 46% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALybatide 2protein3247% helix, 0% strand—
B, CLybatide 2protein3345% helix, 0% strand—

Ligands and binding sites

  • CCN · Acetonitrile · ligand · 4 copies · chains A, C
  • GOL · Glycerol · additive · chains A
  • PG4 · Tetraethylene glycol · additive · chains C

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

Interfaces

2 interfaces between chains.

  • A–C · 425 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 316 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 disulfide (disulfide).

Compared structures

  • 5NGN · Lybatide 2, a cystine-rich peptide from Lycium barbarum · the same entry in another collection · chain A against A, TM-score 1.00

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