MolNFT v1 · #177593 · protein
Crystal structure of MERS-cov 3CLPRO in complex with the non-covalent inhibitor wu-04
7ENE: “Crystal structure of MERS-cov 3CLPRO in complex with the non-covalent inhibitor wu-04”. X-ray diffraction, 1 ligand (J7R). MolNFT v1 #177593 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7ENE
- Type
- protein
- Length
- 1,216 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- A0A0A7E693
- Ligands
- J7R
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C, D | — | protein | 304 | — | A0A0A7E693 |
Ligands and binding sites
- J7R · ~{N}-[(1~{S},2~{R})-2-[[4-bromanyl-2-(methylcarbamoyl)-6-nitro-phenyl]amino]cyclohexyl]isoquinoline-4-carboxamide · ligand · 4 copies · chains A, B, C, D
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7ENE · Crystal structure of MERS-CoV 3CLpro in complex with the non-covalent inhibitor WU-04 · 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 A0A0A7E693
- Elsewhere: RCSB PDB 7ENE · PDBe 7ENE · UniProt A0A0A7E693
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