Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T59328 | Target Info | |||
| Target Name | Epidermal growth factor receptor (EGFR) | ||||
| Synonyms | Receptor tyrosine-protein kinase erbB-1; Proto-oncogene c-ErbB-1; HER1; ERBB1; ERBB | ||||
| Target Type | Successful Target | ||||
| Gene Name | EGFR | ||||
| Biochemical Class | Kinase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | adenosine diphosphate | Ligand Info | |||
| Canonical SMILES | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N | ||||
| InChI | 1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1 | ||||
| InChIKey | XTWYTFMLZFPYCI-KQYNXXCUSA-N | ||||
| PubChem Compound ID | 6022 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 4RIY Crystal structure of an EGFR/HER3 kinase domain heterodimer containing the cancer-associated HER3-E909G mutation | ||||||
| Method | X-ray diffraction | Resolution | 2.98 Å | Mutation | Yes | [1] |
| PDB Sequence |
LVEPLTPSGE
673 APNQALLRIL683 KETEFKKIKV693 LGSGAFGTVY703 KGLWIPEGEK713 VKIPVAIKEL 723 REATSPKANK733 EILDEAYVMA743 SVDNPHVCRL753 LGICLTSTVQ763 LITQLMPFGC 773 LLDYVREHKD783 NIGSQYLLNW793 CVQIAKGMNY803 LEDRRLVHRD813 LAARNVLVKT 823 PQHVKITDFG833 LAKLLGAEEK843 EYHAVPIKWM857 ALESILHRIY867 THQSDVWSYG 877 VTVWELMTFG887 SKPYDGIPAS897 EISSILEKGE907 RLPQPPICTI917 DVYMIMRKCW 927 MIDADSRPKF937 RELIIEFSKM947 ARDPQRYLVI957 QGD
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| PDB ID: 4RIW Crystal structure of an EGFR/HER3 kinase domain heterodimer | ||||||
| Method | X-ray diffraction | Resolution | 3.10 Å | Mutation | Yes | [1] |
| PDB Sequence |
LVEPLTPSGE
673 APNQALLRIL683 KETEFKKIKV693 LGSGAFGTVY703 KGLWIPEGEK713 VKIPVAIKEL 723 REATSPKANK733 EILDEAYVMA743 SVDNPHVCRL753 LGICLTSTVQ763 LITQLMPFGC 773 LLDYVREHKD783 NIGSQYLLNW793 CVQIAKGMNY803 LEDRRLVHRD813 LAARNVLVKT 823 PQHVKITDFG833 LAKLLGAEEK843 EYHAVPIKWM857 ALESILHRIY867 THQSDVWSYG 877 VTVWELMTFG887 SKPYDGIPAS897 EISSILEKGE907 RLPQPPICTI917 DVYMIMRKCW 927 MIDADSRPKF937 RELIIEFSKM947 ARDPQRYLVI957 QGD
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| PDB ID: 4RIX Crystal structure of an EGFR/HER3 kinase domain heterodimer containing the cancer-associated HER3-Q790R mutation | ||||||
| Method | X-ray diffraction | Resolution | 3.10 Å | Mutation | Yes | [1] |
| PDB Sequence |
LVEPLTPSGE
673 APNQALLRIL683 KETEFKKIKV693 LGSGAFGTVY703 KGLWIPEGEK713 VKIPVAIKEL 723 REATSPKANK733 EILDEAYVMA743 SVDNPHVCRL753 LGICLTSTVQ763 LITQLMPFGC 773 LLDYVREHKD783 NIGSQYLLNW793 CVQIAKGMNY803 LEDRRLVHRD813 LAARNVLVKT 823 PQHVKITDFG833 LAKLLGAEEK843 EYHAVPIKWM857 ALESILHRIY867 THQSDVWSYG 877 VTVWELMTFG887 SKPYDGIPAS897 EISSILEKGE907 RLPQPPICTI917 DVYMIMRKCW 927 MIDADSRPKF937 RELIIEFSKM947 ARDPQRYLVI957 QGD
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Structural analysis of the EGFR/HER3 heterodimer reveals the molecular basis for activating HER3 mutations. Sci Signal. 2014 Dec 2;7(354):ra114. | ||||
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