GL1X · GenesisL1 explorer

MolNFT v1 · #143037 · protein

Design of a short thermo-stable alpha-helix embedded in a macrocycle

6ANF · Capped-strapped peptide: “Design of a short thermo-stable alpha-helix embedded in a macrocycle”. Solution nmr, 3 ligands (H00, B0I, NH2). MolNFT v1 #143037 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6ANF
Type
protein
Length
13 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capped-strapped peptide
Ligands
H00, B0I, NH2

Structure

solution nmr · 1 distinct chain · 77% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACapped-strapped peptideprotein1377% helix, 0% strand—

Ligands and binding sites

  • H00 · 4-sulfanylbutanoic acid · ligand · chains A
  • B0I · 3,3'-dimethyl-1,1'-biphenyl · ligand · chains A
  • NH2 · Amino group · ion · chains A

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

Modifications

Observed in the structure: 2 covalent, 1 d-amino (covalent ligand, D-amino acid).

Compared structures

  • 6ANF · Design of a short thermo-stable alpha-helix embedded in a macrocycle · the same entry in another collection · chain A against A, TM-score 1.00

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