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MolNFT v1 · #189588 · protein

Crystal structure of SARS-cov-2 main protease in complex with PF07321332 in spacegroup P1211

7VLP: “Crystal structure of SARS-cov-2 main protease in complex with PF07321332 in spacegroup P1211”. X-ray diffraction, 1 ligand (4WI). MolNFT v1 #189588 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7VLP
Type
protein
Length
602 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P0DTC1
Ligands
4WI

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein303—P0DTC1
B—protein299—P0DTC1

Ligands and binding sites

  • 4WI · (1R,2S,5S)-N-{(1E,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide · ligand · 2 copies · chains A, B

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

Compared structures

  • 7VLP · Crystal structure of SARS-Cov-2 main protease in complex with PF07321332 in spacegroup… · the same entry in another collection · chain A against A, TM-score 1.00

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