6W7O
Ternary complex structure - BTK cIAP compound 17
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004672 | molecular_function | protein kinase activity |
| A | 0004713 | molecular_function | protein tyrosine kinase activity |
| A | 0005524 | molecular_function | ATP binding |
| A | 0006468 | biological_process | protein phosphorylation |
| B | 0004672 | molecular_function | protein kinase activity |
| B | 0004713 | molecular_function | protein tyrosine kinase activity |
| B | 0005524 | molecular_function | ATP binding |
| B | 0006468 | biological_process | protein phosphorylation |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 29 |
| Details | binding site for residue TL7 A 701 |
| Chain | Residue |
| A | LEU408 |
| A | GLY480 |
| A | CYS481 |
| A | ASN484 |
| A | LEU528 |
| A | SER538 |
| A | ASP539 |
| A | PHE540 |
| A | LEU542 |
| A | ASP549 |
| A | HOH875 |
| A | VAL416 |
| A | HOH903 |
| C | ASP303 |
| C | GLY312 |
| C | LEU313 |
| C | ARG314 |
| C | CYS315 |
| C | ASP320 |
| C | GLU325 |
| C | TRP329 |
| C | PHE330 |
| A | ALA428 |
| A | LYS430 |
| A | MET449 |
| A | ILE472 |
| A | THR474 |
| A | GLU475 |
| A | MET477 |
| site_id | AC2 |
| Number of Residues | 32 |
| Details | binding site for residue TL7 B 701 |
| Chain | Residue |
| B | LEU408 |
| B | VAL416 |
| B | ALA428 |
| B | LYS430 |
| B | MET449 |
| B | ILE472 |
| B | THR474 |
| B | GLU475 |
| B | TYR476 |
| B | MET477 |
| B | GLY480 |
| B | CYS481 |
| B | ASN484 |
| B | LEU528 |
| B | SER538 |
| B | ASP539 |
| B | PHE540 |
| B | LEU542 |
| B | ASP549 |
| B | HOH919 |
| D | ASP303 |
| D | VAL304 |
| D | LYS305 |
| D | GLY312 |
| D | LEU313 |
| D | ARG314 |
| D | CYS315 |
| D | TRP316 |
| D | GLU317 |
| D | ASP320 |
| D | GLU325 |
| D | TRP329 |
| site_id | AC3 |
| Number of Residues | 4 |
| Details | binding site for residue ZN C 401 |
| Chain | Residue |
| C | CYS306 |
| C | CYS309 |
| C | HIS326 |
| C | CYS333 |
| site_id | AC4 |
| Number of Residues | 4 |
| Details | binding site for residue ZN D 401 |
| Chain | Residue |
| D | CYS306 |
| D | CYS309 |
| D | HIS326 |
| D | CYS333 |
Functional Information from PROSITE/UniProt
| site_id | PS00107 |
| Number of Residues | 23 |
| Details | PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGTGQFGVVKyGkwrgqyd...........VAIK |
| Chain | Residue | Details |
| A | LEU408-LYS430 |
| site_id | PS00109 |
| Number of Residues | 13 |
| Details | PROTEIN_KINASE_TYR Tyrosine protein kinases specific active-site signature. FLHrDLAARNCLV |
| Chain | Residue | Details |
| A | PHE517-VAL529 |
| site_id | PS01282 |
| Number of Residues | 68 |
| Details | BIR_REPEAT_1 BIR repeat. HaaRmrtfmy.Wpssvpvqpeqlas.AGFyYvgrnDdvkCfcCdgglrcWesgddpwveHakwfPrCefL |
| Chain | Residue | Details |
| C | HIS269-LEU336 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 506 |
| Details | Domain: {"description":"Protein kinase","evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 14 |
| Details | Motif: {"description":"CAV1-binding"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 2 |
| Details | Active site: {"description":"Proton acceptor","evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"},{"source":"PROSITE-ProRule","id":"PRU10028","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 18 |
| Details | Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI5 |
| Number of Residues | 6 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"20052711","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"3K54","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3OCT","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI6 |
| Number of Residues | 2 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"21280133","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"3PIY","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI7 |
| Number of Residues | 2 |
| Details | Modified residue: {"description":"Phosphotyrosine; by LYN and SYK","evidences":[{"source":"PubMed","id":"8630736","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"9012831","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI8 |
| Number of Residues | 2 |
| Details | Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"23186163","evidenceCode":"ECO:0007744"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI9 |
| Number of Residues | 2 |
| Details | Modified residue: {"description":"Phosphotyrosine","evidences":[{"source":"PubMed","id":"15375214","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI10 |
| Number of Residues | 2 |
| Details | Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"15375214","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI11 |
| Number of Residues | 134 |
| Details | Repeat: {"description":"BIR 3"} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI12 |
| Number of Residues | 8 |
| Details | Binding site: {} |
| Chain | Residue | Details |
