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MolNFT v1 · #152578 · protein

Solution structure of bicyclic peptide pb-18

6IMH · (ACE)-gly-cys-pro-cys-glu-pro-ser-tyr-leu-cys-pro-TRP-leu…: “Solution structure of bicyclic peptide pb-18”. Solution nmr, 2 ligands (ACE, NH2). MolNFT v1 #152578 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6IMH
Type
protein
Length
16 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
(ACE)-gly-cys-pro-cys-glu-pro-ser-tyr-leu-cys-pro-TRP-leu- pro-gly-cys-(NH2)
Ligands
ACE, NH2

Structure

solution nmr · 1 distinct chain · 19% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A(ACE)-gly-cys-pro-cys-glu-pro-ser-tyr-leu-cys-pro-TRP-leu- pro-gly-cys-(NH2)protein1619% helix, 0% strand—

Ligands and binding sites

  • ACE · Acetyl group · 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 disulfide, 1 covalent (disulfide, covalent ligand).

Compared structures

  • 6IMH · Solution Structure of Bicyclic Peptide pb-18 · the same entry in another collection · chain A against A, TM-score 1.00

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