DRUG BINDING INTERFACES MAPPED TO 'PROTEIN KINASE A'
List of Binding Interfaces (Click on the entry ID to view details of interfaces and pattern clusters) (Note that ASSAM search use only 3-12 residue containing patterns)DrReposER ID | PDB | Ligand | Organism | Macromolecule | Pfam | Res. | Interface | HETATM |
---|---|---|---|---|---|---|---|---|
1IEP_A_STIA201 | 1iep | STI DB00619(Imatinib) | Mus musculus | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL | PF07714(Pkinase_Tyr) | 18 | LEU A 248TYR A 253VAL A 256ALA A 269LYS A 271GLU A 286VAL A 289MET A 290VAL A 299ILE A 313THR A 315PHE A 317MET A 318GLY A 321ARG A 362LEU A 370ALA A 380ASP A 381 | STI A 201 |
1IEP_B_STIB202 | 1iep | STI DB00619(Imatinib) | Mus musculus | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL | no annotation | 19 | LEU B 248TYR B 253VAL B 256ALA B 269LYS B 271GLU B 286VAL B 289MET B 290ILE B 293VAL B 299ILE B 313THR B 315PHE B 317MET B 318GLY B 321ARG B 362LEU B 370ALA B 380ASP B 381 | STI B 202 |
1OPJ_A_STIA3 | 1opj | STI DB00619(Imatinib) | Mus musculus | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 17 | LEU A 267TYR A 272VAL A 275ALA A 288LYS A 290GLU A 305VAL A 308MET A 309ILE A 312VAL A 318ILE A 332THR A 334PHE A 336MET A 337LEU A 389ALA A 399ASP A 400 | STI A 3 |
1OPJ_B_STIB4 | 1opj | STI DB00619(Imatinib) | Mus musculus | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 18 | LEU B 267TYR B 272VAL B 275ALA B 288LYS B 290GLU B 305VAL B 308MET B 309ILE B 312VAL B 318ILE B 332THR B 334PHE B 336MET B 337GLY B 340ARG B 381ALA B 399ASP B 400 | STI B 4 |
2GQG_A_1N1A501 | 2gqg | 1N1 DB01254(Dasatinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 14 | LEU A 248TYR A 253ALA A 269LYS A 271GLU A 286MET A 290VAL A 299ILE A 313THR A 315PHE A 317MET A 318GLY A 321LEU A 370ALA A 380 | 1N1 A 501 |
2GQG_B_1N1B502 | 2gqg | 1N1 DB01254(Dasatinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 14 | LEU B 248VAL B 256ALA B 269LYS B 271GLU B 286MET B 290VAL B 299ILE B 313THR B 315MET B 318TYR B 320GLY B 321LEU B 370ALA B 380 | 1N1 B 502 |
2HYY_A_STIA600 | 2hyy | STI DB00619(Imatinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 18 | LEU A 248TYR A 253VAL A 256ALA A 269LYS A 271GLU A 286VAL A 289MET A 290ILE A 293VAL A 299ILE A 313THR A 315PHE A 317GLY A 321ARG A 362LEU A 370ALA A 380ASP A 381 | STI A 600 |
2HYY_B_STIB600 | 2hyy | STI DB00619(Imatinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 18 | LEU B 248TYR B 253VAL B 256ALA B 269LYS B 271GLU B 286VAL B 289MET B 290ILE B 293VAL B 299ILE B 313THR B 315PHE B 317MET B 318GLY B 321LEU B 370ALA B 380ASP B 381 | STI B 600 |
2HYY_C_STIC600 | 2hyy | STI DB00619(Imatinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 18 | LEU C 248TYR C 253VAL C 256ALA C 269LYS C 271GLU C 286VAL C 289MET C 290ILE C 293VAL C 299ILE C 313THR C 315PHE C 317MET C 318GLY C 321LEU C 370ALA C 380ASP C 381 | STI C 600 |
2HYY_D_STID600 | 2hyy | STI DB00619(Imatinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 16 | LEU D 248TYR D 253VAL D 256ALA D 269LYS D 271GLU D 286MET D 290ILE D 293VAL D 299ILE D 313THR D 315PHE D 317MET D 318LEU D 370ALA D 380ASP D 381 | STI D 600 |
3CS9_A_NILA600 | 3cs9 | NIL DB04868(Nilotinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 22 | LEU A 248TYR A 253VAL A 256ALA A 269LYS A 271LYS A 285GLU A 286VAL A 289MET A 290ILE A 293LEU A 298VAL A 299ILE A 313THR A 315PHE A 317GLY A 321PHE A 359HIS A 361LEU A 370VAL A 379ALA A 380ASP A 381 | NIL A 600 |
3CS9_B_NILB600 | 3cs9 | NIL DB04868(Nilotinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 21 | LEU B 248TYR B 253VAL B 256ALA B 269LYS B 271GLU B 286VAL B 289MET B 290ILE B 293LEU B 298VAL B 299ILE B 313THR B 315GLY B 321PHE B 359HIS B 361LEU B 370VAL B 379ALA B 380ASP B 381PHE B 382 | NIL B 600 |
3CS9_C_NILC600 | 3cs9 | NIL DB04868(Nilotinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 21 | LEU C 248TYR C 253VAL C 256ALA C 269LYS C 271GLU C 286VAL C 289MET C 290ILE C 293LEU C 298VAL C 299ILE C 313THR C 315PHE C 317MET C 318PHE C 359HIS C 361VAL C 379ALA C 380ASP C 381PHE C 382 | NIL C 600 |
3CS9_D_NILD600 | 3cs9 | NIL DB04868(Nilotinib) | Homo sapiens | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 18 | LEU D 248TYR D 253VAL D 256ALA D 269LYS D 271GLU D 286VAL D 289MET D 290ILE D 293LEU D 298THR D 315PHE D 317GLY D 321PHE D 359HIS D 361LEU D 370ALA D 380ASP D 381 | NIL D 600 |
3GVU_A_STIA1001 | 3gvu | STI DB00619(Imatinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL2 | PF07714(Pkinase_Tyr) | 17 | LEU A 294TYR A 299VAL A 302ALA A 315LYS A 317GLU A 332VAL A 335MET A 336ILE A 339VAL A 345ILE A 359THR A 361TYR A 363MET A 364LEU A 416ALA A 426ASP A 427 | STI A1001 |
3GVU_A_STIA1002 | 3gvu | STI DB00619(Imatinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL2 | PF07714(Pkinase_Tyr) | 8 | ALA A 383VAL A 384LEU A 386LEU A 387ALA A 479GLY A 509PRO A 511VAL A 514 | STI A1002 |
3IK3_A_0LIA1 | 3ik3 | 0LI DB08901(Ponatinib) | Mus musculus | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 19 | LEU A 248TYR A 253ALA A 269LYS A 271GLU A 286VAL A 289MET A 290ILE A 293LEU A 298VAL A 299ILE A 313ILE A 315MET A 318HIS A 361ARG A 362LEU A 370ALA A 380ASP A 381PHE A 382 | 0LI A 1 |
3IK3_B_0LIB2 | 3ik3 | 0LI DB08901(Ponatinib) | Mus musculus | PROTO-ONCOGENETYROSINE-PROTEINKINASE ABL1 | no annotation | 19 | LEU B 248TYR B 253ALA B 269LYS B 271GLU B 286VAL B 289MET B 290ILE B 293LEU B 298VAL B 299ILE B 313ILE B 315MET B 318HIS B 361ARG B 362LEU B 370ALA B 380ASP B 381PHE B 382 | 0LI B 2 |
3K5V_A_STIA2 | 3k5v | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 18 | LEU A 267TYR A 272VAL A 275ALA A 288LYS A 290GLU A 305VAL A 308MET A 309ILE A 312VAL A 318ILE A 332THR A 334PHE A 336MET A 337GLY A 340LEU A 389ALA A 399ASP A 400 | STI A 2 |
3K5V_B_STIB2 | 3k5v | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | no annotation | 18 | LEU B 267TYR B 272VAL B 275ALA B 288LYS B 290GLU B 305VAL B 308MET B 309ILE B 312VAL B 318ILE B 332THR B 334PHE B 336MET B 337GLY B 340LEU B 389ALA B 399ASP B 400 | STI B 2 |
3MS9_A_STIA1 | 3ms9 | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 18 | LEU A 248TYR A 253VAL A 256ALA A 269LYS A 271GLU A 286VAL A 289MET A 290ILE A 293VAL A 299ILE A 313THR A 315PHE A 317MET A 318ARG A 362LEU A 370ALA A 380ASP A 381 | STI A 1 |
3MS9_B_STIB1 | 3ms9 | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | no annotation | 19 | LEU B 248TYR B 253VAL B 256ALA B 269LYS B 271GLU B 286VAL B 289MET B 290ILE B 293VAL B 299ILE B 313THR B 315PHE B 317MET B 318GLY B 321ARG B 362LEU B 370ALA B 380ASP B 381 | STI B 1 |
3MSS_A_STIA1 | 3mss | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 18 | LEU A 248TYR A 253VAL A 256ALA A 269LYS A 271GLU A 286VAL A 289MET A 290ILE A 293VAL A 299ILE A 313THR A 315PHE A 317MET A 318ARG A 362LEU A 370ALA A 380ASP A 381 | STI A 1 |
3MSS_B_STIB1 | 3mss | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | no annotation | 19 | LEU B 248TYR B 253VAL B 256ALA B 269LYS B 271GLU B 286VAL B 289MET B 290ILE B 293VAL B 299ILE B 313THR B 315PHE B 317MET B 318GLY B 321ARG B 362LEU B 370ALA B 380ASP B 381 | STI B 1 |
3MSS_C_STIC1 | 3mss | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | no annotation | 18 | LEU C 248TYR C 253VAL C 256ALA C 269LYS C 271GLU C 286VAL C 289MET C 290ILE C 293VAL C 299ILE C 313THR C 315PHE C 317MET C 318ARG C 362LEU C 370ALA C 380ASP C 381 | STI C 1 |
3MSS_D_STID1 | 3mss | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | no annotation | 18 | LEU D 248TYR D 253VAL D 256ALA D 269LYS D 271GLU D 286VAL D 289MET D 290ILE D 293VAL D 299ILE D 313THR D 315PHE D 317MET D 318GLY D 321LEU D 370ALA D 380ASP D 381 | STI D 1 |
3OXZ_A_0LIA1 | 3oxz | 0LI DB08901(Ponatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 21 | LEU A 248TYR A 253ALA A 269LYS A 271GLU A 286VAL A 289MET A 290ILE A 293LEU A 298VAL A 299ILE A 313THR A 315MET A 318GLY A 321HIS A 361ARG A 362LEU A 370VAL A 379ALA A 380ASP A 381PHE A 382 | 0LI A 1 |
3UE4_A_DB8A601 | 3ue4 | DB8 DB06616(Bosutinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 12 | LEU A 248ALA A 269LYS A 271GLU A 286VAL A 299ILE A 313THR A 315PHE A 317MET A 318GLY A 321LEU A 370PHE A 382 | DB8 A 601 |
3UE4_B_DB8B601 | 3ue4 | DB8 DB06616(Bosutinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | no annotation | 14 | LEU B 248VAL B 256ALA B 269LYS B 271GLU B 286MET B 290VAL B 299ILE B 313THR B 315PHE B 317MET B 318GLY B 321LEU B 370PHE B 382 | DB8 B 601 |
4TWP_A_AXIA601 | 4twp | AXI DB06626(Axitinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 12 | LEU A 248TYR A 253VAL A 256ALA A 269LYS A 271PHE A 317MET A 318GLY A 321ASN A 368LEU A 370ALA A 380ASP A 381 | AXI A 601 |
4TWP_B_AXIB601 | 4twp | AXI DB06626(Axitinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | no annotation | 12 | LEU B 248TYR B 253VAL B 256ALA B 269LYS B 271PHE B 317MET B 318GLY B 321ASN B 368LEU B 370ALA B 380ASP B 381 | AXI B 601 |
4WA9_A_AXIA9000 | 4wa9 | AXI DB06626(Axitinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 11 | LEU A 248TYR A 253ALA A 269LYS A 271THR A 315MET A 318GLY A 321ASN A 368LEU A 370ALA A 380PHE A 382 | AXI A9000 |
4WA9_B_AXIB9000 | 4wa9 | AXI DB06626(Axitinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | no annotation | 12 | TYR B 253VAL B 256ALA B 269LYS B 271THR B 315PHE B 317MET B 318GLY B 321ASN B 368LEU B 370ALA B 380PHE B 382 | AXI B9000 |
4XEY_A_1N1A601 | 4xey | 1N1 DB01254(Dasatinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 15 | LEU A 267VAL A 275ALA A 288LYS A 290MET A 309VAL A 318ILE A 332THR A 334PHE A 336MET A 337GLY A 340LEU A 389ALA A 399ASP A 400PHE A 401 | 1N1 A 601 |
4XEY_B_1N1B601 | 4xey | 1N1 DB01254(Dasatinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | no annotation | 15 | LEU B 267VAL B 275ALA B 288LYS B 290MET B 309VAL B 318ILE B 332THR B 334PHE B 336MET B 337GLY B 340LEU B 389ALA B 399ASP B 400PHE B 401 | 1N1 B 601 |
5MO4_A_NILA601 | 5mo4 | NIL DB04868(Nilotinib) | Homo sapiens | TYROSINE-PROTEINKINASE ABL1 | PF00017(SH2)PF00018(SH3_1)PF07714(Pkinase_Tyr) | 22 | LEU A 267TYR A 272VAL A 275ALA A 288LYS A 290GLU A 305VAL A 308MET A 309ILE A 312LEU A 317VAL A 318ILE A 332ILE A 334PHE A 336MET A 337GLY A 340PHE A 378HIS A 380LEU A 389ALA A 399ASP A 400PHE A 401 | NIL A 601 |
6HD4_A_STIA604 | 6hd4 | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 17 | TYR A 272VAL A 275ALA A 288LYS A 290GLU A 305VAL A 308MET A 309ILE A 312VAL A 318ILE A 332THR A 334PHE A 336MET A 337GLY A 340LEU A 389ALA A 399ASP A 400 | STI A 604 |
6HD4_B_STIB602 | 6hd4 | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | None | 18 | LEU B 267TYR B 272VAL B 275ALA B 288LYS B 290GLU B 305VAL B 308MET B 309ILE B 312VAL B 318ILE B 332THR B 334PHE B 336MET B 337GLY B 340LEU B 389ALA B 399ASP B 400 | STI B 602 |
6HD6_A_STIA603 | 6hd6 | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | PF07714(Pkinase_Tyr) | 17 | LEU A 267TYR A 272VAL A 275ALA A 288LYS A 290GLU A 305MET A 309ILE A 312VAL A 318ILE A 332THR A 334PHE A 336MET A 337GLY A 340LEU A 389ALA A 399ASP A 400 | STI A 603 |
6HD6_B_STIB601 | 6hd6 | STI DB00619(Imatinib) | Mus musculus | TYROSINE-PROTEINKINASE ABL1 | None | 19 | LEU B 267TYR B 272VAL B 275ALA B 288LYS B 290GLU B 305VAL B 308MET B 309ILE B 312VAL B 318ILE B 332THR B 334PHE B 336MET B 337GLY B 340ARG B 381LEU B 389ALA B 399ASP B 400 | STI B 601 |