3MSS
Abl kinase in complex with imatinib and fragment (FRAG2) in the myristate site
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 |
| C | 0004672 | molecular_function | protein kinase activity |
| C | 0004713 | molecular_function | protein tyrosine kinase activity |
| C | 0005524 | molecular_function | ATP binding |
| C | 0006468 | biological_process | protein phosphorylation |
| D | 0004672 | molecular_function | protein kinase activity |
| D | 0004713 | molecular_function | protein tyrosine kinase activity |
| D | 0005524 | molecular_function | ATP binding |
| D | 0006468 | biological_process | protein phosphorylation |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 16 |
| Details | BINDING SITE FOR RESIDUE STI A 1 |
| Chain | Residue |
| A | HOH93 |
| A | PHE317 |
| A | MET318 |
| A | ILE360 |
| A | HIS361 |
| A | ALA380 |
| A | ASP381 |
| A | PHE382 |
| A | LEU248 |
| A | ALA269 |
| A | LYS271 |
| A | GLU286 |
| A | MET290 |
| A | VAL299 |
| A | ILE313 |
| A | THR315 |
| site_id | AC2 |
| Number of Residues | 17 |
| Details | BINDING SITE FOR RESIDUE STI B 1 |
| Chain | Residue |
| B | HOH65 |
| B | LEU248 |
| B | ALA269 |
| B | LYS271 |
| B | GLU286 |
| B | MET290 |
| B | ILE293 |
| B | VAL299 |
| B | ILE313 |
| B | THR315 |
| B | PHE317 |
| B | MET318 |
| B | ILE360 |
| B | HIS361 |
| B | ALA380 |
| B | ASP381 |
| B | PHE382 |
| site_id | AC3 |
| Number of Residues | 17 |
| Details | BINDING SITE FOR RESIDUE STI C 1 |
| Chain | Residue |
| C | HOH48 |
| C | LEU248 |
| C | ALA269 |
| C | LYS271 |
| C | GLU286 |
| C | MET290 |
| C | ILE293 |
| C | VAL299 |
| C | ILE313 |
| C | THR315 |
| C | PHE317 |
| C | MET318 |
| C | ILE360 |
| C | HIS361 |
| C | ALA380 |
| C | ASP381 |
| C | PHE382 |
| site_id | AC4 |
| Number of Residues | 17 |
| Details | BINDING SITE FOR RESIDUE STI D 1 |
| Chain | Residue |
| D | HOH86 |
| D | ALA269 |
| D | LYS271 |
| D | GLU286 |
| D | VAL289 |
| D | MET290 |
| D | ILE293 |
| D | VAL299 |
| D | ILE313 |
| D | THR315 |
| D | PHE317 |
| D | MET318 |
| D | ILE360 |
| D | HIS361 |
| D | ALA380 |
| D | ASP381 |
| D | PHE382 |
| site_id | AC5 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE MS7 A 516 |
| Chain | Residue |
| A | ALA337 |
| A | LEU341 |
| A | ALA433 |
| A | PRO465 |
| A | VAL468 |
| A | HOH607 |
| A | HOH690 |
| site_id | AC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MS7 B 516 |
| Chain | Residue |
| B | ALA337 |
| B | LEU341 |
| B | ALA433 |
| B | PRO465 |
| B | HOH546 |
| site_id | AC7 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MS7 C 516 |
| Chain | Residue |
| C | ALA337 |
| C | LEU341 |
| C | ALA433 |
| C | PRO465 |
| C | VAL468 |
| C | HOH577 |
| site_id | AC8 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MS7 D 516 |
| Chain | Residue |
| D | ALA337 |
| D | LEU341 |
| D | ALA433 |
| D | PRO465 |
| D | HOH602 |
Functional Information from PROSITE/UniProt
| site_id | PS00107 |
| Number of Residues | 24 |
| Details | PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. LGGGQYGEVYeGvwkkyslt..........VAVK |
| Chain | Residue | Details |
| A | LEU248-LYS271 |
| site_id | PS00109 |
| Number of Residues | 13 |
| Details | PROTEIN_KINASE_TYR Tyrosine protein kinases specific active-site signature. FIHrDLAARNCLV |
| Chain | Residue | Details |
| A | PHE359-VAL371 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 4 |
| 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_FI2 |
| Number of Residues | 56 |
| Details | Binding site: {"evidences":[{"evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 4 |
| Details | Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 12 |
| Details | Modified residue: {"description":"Phosphotyrosine","evidences":[{"source":"UniProtKB","id":"P00519","evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI5 |
| Number of Residues | 4 |
| Details | Modified residue: {"description":"Phosphotyrosine; by autocatalysis and SRC-type Tyr-kinases","evidences":[{"source":"PubMed","id":"10988075","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"12748290","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI6 |
| Number of Residues | 4 |
| Details | Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"9109492","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
