MolNFT v1 · #186956 · protein
Structure of the SARS-cov-2 main protease in complex with inhibitor MPI28
7RW1: “Structure of the SARS-cov-2 main protease in complex with inhibitor MPI28”. X-ray diffraction, 1 ligand (800). MolNFT v1 #186956 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7RW1
- Type
- protein
- Length
- 602 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P0DTD1
- Ligands
- 800
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | — | protein | 301 | — | P0DTD1 |
Ligands and binding sites
- 800 · N-(1H-indole-2-carbonyl)-L-valyl-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-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
- 7RW1 · Structure of the SARS-CoV-2 main protease in complex with inhibitor MPI28 · the same entry in another collection · chain A against A, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt P0DTD1
- Elsewhere: RCSB PDB 7RW1 · PDBe 7RW1 · UniProt P0DTD1
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