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1.6A resolution structure of poliovirus 3C protease containing a covalently bound dipeptidyl inhibitor

Analyse 1.6A resolution structure of poliovirus 3C protease containing a covalently… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4DCD
Type
protein
Length
184 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Genome polyprotein
EC
3.4.22.28
UniProt
P03300
Ligands
K36, SO4

Structure

x-ray diffraction · 1 distinct chain · 13% helix, 53% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGenome polyprotein (EC 3.4.22.28)protein18413% helix, 53% strandP03300

Ligands and binding sites

  • K36 · (1S,2S)-2-({N-[(benzyloxy)carbonyl]-L-leucyl}amino)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid · ligand · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A
  • DTT · 2,3-dihydroxy-1,4-dithiobutane · additive · 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

  • 4DCD · 1.6A resolution structure of PolioVirus 3C Protease Containing a covalently bound… · the same entry in another collection · chain A against A, TM-score 1.00

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