6R1V
Solution structure of sortase A from S. aureus in complex with 2-(aminomethyl)-3-hydroxy-4H-pyran-4-one based prodrug
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 5 |
| Details | binding site for residue JPT A 201 |
| Chain | Residue |
| A | ALA60 |
| A | ILE124 |
| A | CYS126 |
| A | TRP136 |
| A | ARG139 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 1 |
| Details | Active site: {"description":"Proton donor/acceptor","evidences":[{"source":"PubMed","id":"11371637","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"11714722","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"15117963","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"15247224","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"17518446","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 1 |
| Details | Active site: {"description":"Acyl-thioester intermediate","evidences":[{"source":"PubMed","id":"11371637","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"11714722","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"15117963","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"15247224","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"17518446","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 5 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"19592495","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"16269411","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 1 |
| Details | Site: {"description":"Transition state stabilizer","evidences":[{"source":"PubMed","id":"15117963","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"15247224","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"17518446","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
