MolNFT v1 · #169611 · protein
Covalent complex of SARS-cov main protease with ethyl (4R)-4-({N-[(4- methoxy-1H-indol-2-YL)CARBONYL]-L-LEUCYL}AMINO)-5-[(3S)-2- oxopyrrolidin-3-YL]PENTANOATE
6XHO: “Covalent complex of SARS-cov main protease with ethyl (4R)-4-({N-[(4…”. X-ray diffraction, 1 ligand (V34). MolNFT v1 #169611 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6XHO
- Type
- protein
- Length
- 594 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P0C6U8
- Ligands
- V34
Structure
x-ray diffraction · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 300 | — | P0C6U8 |
| B | — | protein | 294 | — | P0C6U8 |
Ligands and binding sites
- V34 · ethyl (2E,4S)-4-{[N-(4-methoxy-1H-indole-2-carbonyl)-L-leucyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate · ligand · 2 copies · chains A, B
- EDO · 1,2-ethanediol · additive · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6XHO · Covalent complex of SARS-CoV main protease with ethyl… · 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 P0C6U8
- Elsewhere: RCSB PDB 6XHO · PDBe 6XHO · UniProt P0C6U8
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