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NMR Solution Structures of butyryl-ACP (a non-polar, non pathway intermediate) from the actinorhodin polyketide synthase in Streptomyces coelicolor

Analyse NMR Solution Structures of butyryl-ACP (a non-polar, non pathway intermediate)… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2KG9
Type
protein
Length
86 residues
Chains
1
Method
solution nmr
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
NOT
Source
Streptomyces coelicolor
Molecule
Actinorhodin polyketide synthase acyl carrier protein
UniProt
Q02054
Ligands
PSR

Structure

solution nmr · resolution NOT · 1 distinct chain · 49% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AActinorhodin polyketide synthase acyl carrier proteinprotein8649% helix, 0% strandQ02054

Ligands and binding sites

  • PSR · Thiobutyric acid S-{2-[3-(2-hydroxy-3,3-dimethyl-4-phosphonooxy-butyrylamino)-propionylamino]-ethyl} ester · ligand · chains A

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

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 2KG9 · NMR solution structures of butyryl-acp (a non-polar, non pathway intermediate) from the… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q02054 · AlphaFold monomer V2.0 prediction for actinorhodin polyketide synthase acyl carrier… · a predicted model of the same protein · chain A against A, TM-score 0.84

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