5NH0
Structure of human coronavirus NL63 main protease in complex with the alpha-ketoamide tert-Butyl ((S)-4-(benzylamino)-3,4-dioxo-1-((S)-2-oxopyrrolidin-3-yl)b- utan-2-yl)carbamate (tert-butyl -GlnLactam-CO-CO-NH-benzyl)
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C (A, B, C) | 3C-like proteinase | polymer | 300 | 32407.7 | 3 | UniProt (P0C6X5) Pfam (PF05409) | Human coronavirus NL63 (HCoV-NL63) | 3CL-PRO,3CLp,M-PRO,nsp5,p34 |
| 2 | D, G, H (A, B, C) | ~{tert}-butyl ~{N}-[(2~{S},3~{R})-3-oxidanyl-4-oxidanylidene-1-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]-4-[(phenylmethyl)amino]butan-2-yl]carbamate | non-polymer | 391.5 | 3 | Chemie (8X8) | |||
| 3 | E, F, K (A, C) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 3 | Chemie (DMS) | |||
| 4 | I, J (C) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
| 5 | L, M, N (A, B, C) | water | water | 18.0 | 472 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 97223.2 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 1593.0 | |
| All* | Total formula weight | 98816.2 |
