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MolNFT v1 · #186948 · protein

Structure of the SARS-cov-2 main protease in complex with inhibitor MPI20

7RVT: “Structure of the SARS-cov-2 main protease in complex with inhibitor MPI20”. X-ray diffraction, 1 ligand (7XK). MolNFT v1 #186948 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7RVT
Type
protein
Length
600 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P0DTD1
Ligands
7XK

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein300—P0DTD1

Ligands and binding sites

  • 7XK · N~2~-[(2S)-2-{[(benzyloxy)carbonyl]amino}-2-cyclopropylacetyl]-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-4-methyl-L-leucinamide · ligand · 2 copies · chains A, B

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

Compared structures

  • 7RVT · Structure of the SARS-CoV-2 main protease in complex with inhibitor MPI20 · the same entry in another collection · chain A against A, TM-score 1.00

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