9PAK
Crystal structure of MERS-CoV 3CLpro with ALG-097655 (Inhibitor 2)
This is a non-PDB format compatible entry.
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, D (A, B, C, D) | 3C-like proteinase nsp5 | polymer | 306 | 33354.2 | 4 | UniProt (K9N7C7) Pfam (PF05409) | Middle East respiratory syndrome-related coronavirus | 3CL-PRO,3CLp,nsp5 |
| 2 | E, F, G, H (A, B, C, D) | (1R,2S,3S,6R,7S)-N-{(1Z,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-4-[(2S)-4,4,4-trifluoro-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3-carboxamide (non-preferred name) | non-polymer | 579.5 | 4 | Chemie (A1CHJ) | |||
| 3 | I, J, K, L (A, B, C, D) | water | water | 18.0 | 764 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 133416.7 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 2318.1 | |
| All* | Total formula weight | 135734.8 |
