7AQE
Structure of SARS-CoV-2 Main Protease bound to UNC-2327
Functional Information from GO Data
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 5 |
| Details | binding site for residue CL A 401 |
| Chain | Residue |
| A | SER284 |
| A | SER284 |
| A | ALA285 |
| A | ALA285 |
| A | LEU286 |
| site_id | AC2 |
| Number of Residues | 8 |
| Details | binding site for residue DMS A 402 |
| Chain | Residue |
| A | THR224 |
| A | ASP263 |
| A | HOH527 |
| A | HOH615 |
| A | GLN74 |
| A | LEU75 |
| A | ARG76 |
| A | PHE223 |
| site_id | AC3 |
| Number of Residues | 2 |
| Details | binding site for residue DMS A 403 |
| Chain | Residue |
| A | TYR37 |
| A | PHE103 |
| site_id | AC4 |
| Number of Residues | 13 |
| Details | binding site for residue RV5 A 404 |
| Chain | Residue |
| A | THR25 |
| A | HIS41 |
| A | CYS44 |
| A | THR45 |
| A | SER46 |
| A | MET49 |
| A | ASN142 |
| A | GLU166 |
| A | LEU167 |
| A | PRO168 |
| A | GLN189 |
| A | GLY251 |
| A | HOH661 |
| site_id | AC5 |
| Number of Residues | 3 |
| Details | binding site for residue DMS A 405 |
| Chain | Residue |
| A | ASN53 |
| A | TYR54 |
| A | GLU55 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 305 |
| Details | Domain: {"description":"Peptidase C30","evidences":[{"source":"PROSITE-ProRule","id":"PRU00772","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 1 |
| Details | Active site: {"description":"For 3CL-PRO activity","evidences":[{"source":"PROSITE-ProRule","id":"PRU00772","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"32198291","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 1 |
| Details | Active site: {"description":"Nucleophile; for 3CL-PRO activity","evidences":[{"source":"PROSITE-ProRule","id":"PRU00772","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"32198291","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 3 |
| Details | Cross-link: {"description":"Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in ubiquitin)","evidences":[{"source":"PubMed","id":"39223933","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
