5E0J
1.20 A resolution structure of Norovirus 3CL protease in complex with a triazole-based macrocyclic (21-mer) inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Norovirus 3C-like protease | polymer | 188 | 20126.1 | 1 | UniProt (Q83883) In PDB | Norwalk virus (Hu/NV/NV/1968/US) | |
| 2 | A | CHLORIDE ION | non-polymer | 35.5 | 3 | Chemie (CL) | |||
| 3 | A | (phenylmethyl) ~{N}-[(12~{S},15~{S},18~{S})-15-(cyclohexylmethyl)-12-(hydroxymethyl)-9,14,17-tris(oxidanylidene)-1,8,13,16,21,22-hexazabicyclo[18.2.1]tricosa-20(23),21-dien-18-yl]carbamate | non-polymer | 639.8 | 1 | BIRD (PRD_002203) Chemie (5LJ) | |||
| 4 | water | water | 18.0 | 170 | Chemie (HOH) |
Sequence modifications
A: 1 - 181 (UniProt: Q83883)
| PDB | External Database | Details |
|---|---|---|
| Met -6 | - | expression tag |
| His -5 | - | expression tag |
| His -4 | - | expression tag |
| His -3 | - | expression tag |
| His -2 | - | expression tag |
| His -1 | - | expression tag |
| His 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 20126.1 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 746.1 | |
| All* | Total formula weight | 20872.3 |
