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The crystal structure of papain-like protease of SARS cov-2 , C111S mutant, in complex with PLP_SNYDER457 inhibitor

Analyse The crystal structure of papain-like protease of SARS cov-2 , C111S mutant, in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7JIR
Type
protein
Length
313 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P0DTC1
Ligands
TTT, ZN, CL

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein313—P0DTC1

Ligands and binding sites

  • TTT · 5-amino-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide · ligand · chains A
  • ZN · Zinc ion · metal · 4 copies · chains A
  • CL · Chloride ion · ion · 4 copies · chains A
  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · chains A
  • ACT · Acetate ion · additive · chains A

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

Compared structures

  • 7JIR · The crystal structure of Papain-Like Protease of SARS CoV-2 , C111S mutant, in complex… · the same entry in another collection · chain A against A, TM-score 1.00

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