3VB4
Crystal structure of SARS-CoV 3C-like protease with B4Z
Functional Information from GO Data
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO A 401 |
| Chain | Residue |
| A | LYS5 |
| A | TYR126 |
| A | GLN127 |
| B | LYS5 |
| B | TYR126 |
| B | GLN127 |
| B | HOH583 |
| site_id | AC2 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO A 402 |
| Chain | Residue |
| A | ARG88 |
| A | THR35 |
| A | SER81 |
| site_id | AC3 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO A 403 |
| Chain | Residue |
| A | ASN84 |
| A | HOH521 |
| site_id | AC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO B 401 |
| Chain | Residue |
| B | ARG105 |
| B | ILE106 |
| B | PRO108 |
| B | TYR182 |
| B | HOH509 |
| site_id | AC5 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO B 402 |
| Chain | Residue |
| A | ARG105 |
| A | HIS134 |
| A | GLY183 |
| B | ASP245 |
| B | ASP248 |
| site_id | AC6 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO B 403 |
| Chain | Residue |
| A | GLY11 |
| A | LYS12 |
| B | GLY11 |
| B | GLU14 |
| B | GLY15 |
| B | LYS97 |
| B | HOH594 |
| site_id | AC7 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE GOL B 404 |
| Chain | Residue |
| A | HOH503 |
| B | PRO108 |
| B | GLU240 |
| B | HIS246 |
| B | HOH595 |
| B | HOH597 |
| B | HOH605 |
| site_id | AC8 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO B 405 |
| Chain | Residue |
| B | SER254 |
| B | ALA260 |
| B | VAL261 |
| B | LEU262 |
| site_id | AC9 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO B 406 |
| Chain | Residue |
| A | ASP248 |
| B | ASN133 |
| B | PRO184 |
| B | PHE185 |
| B | ALA194 |
| B | GLY195 |
| site_id | BC1 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR CHAIN E OF B4Z INHIBITOR |
| Chain | Residue |
| A | LEU27 |
| A | PHE140 |
| A | LEU141 |
| A | GLY143 |
| A | CYS145 |
| A | HIS163 |
| A | HIS164 |
| A | MET165 |
| A | GLU166 |
| A | PRO168 |
| A | HIS172 |
| A | GLN189 |
| A | THR190 |
| A | ALA191 |
| A | GLN192 |
| site_id | BC2 |
| Number of Residues | 11 |
| Details | BINDING SITE FOR CHAIN F OF B4Z INHIBITOR |
| Chain | Residue |
| B | HIS41 |
| B | PHE140 |
| B | LEU141 |
| B | CYS145 |
| B | HIS163 |
| B | HIS164 |
| B | MET165 |
| B | GLU166 |
| B | GLN189 |
| B | THR190 |
| B | ALA191 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 2 |
| Details | Active site: {"description":"For 3CL-PRO activity","evidences":[{"source":"PROSITE-ProRule","id":"PRU00772","evidenceCode":"ECO:0000255"},{"source":"PubMed","id":"16306590","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 2 |
| Details | Active site: {"description":"For 3CL-PRO activity","evidences":[{"source":"PROSITE-ProRule","id":"PRU00772","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 305 |
| Details | Domain: {"description":"Peptidase C30","evidences":[{"source":"PROSITE-ProRule","id":"PRU00772","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
