Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T94479 | Target Info | |||
| Target Name | Ribosomal protein S6 kinase beta-1 (S6K1) | ||||
| Synonyms | p70-S6K 1; p70 ribosomal S6 kinase alpha; p70 S6KA; p70 S6K-alpha; p70 S6 kinase alpha; Serine/threonine-protein kinase 14A; STK14A; S6K-beta-1; S6K; Ribosomal protein S6 kinase I; P70S6K1; P70-S6K; 70 kDa ribosomal protein S6 kinase 1 | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | RPS6KB1 | ||||
| Biochemical Class | Kinase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | L-serine-O-phosphate | Ligand Info | |||
| Canonical SMILES | C(C(C(=O)O)N)OP(=O)(O)O | ||||
| InChI | 1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1 | ||||
| InChIKey | BZQFBWGGLXLEPQ-REOHCLBHSA-N | ||||
| PubChem Compound ID | 68841 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 7N93 P70 S6K1 IN COMPLEX WITH MSC2363318A-1 | ||||||
| Method | X-ray diffraction | Resolution | 2.74 Å | Mutation | Yes | [1] |
| PDB Sequence |
RPECFELLRV
96 LGKGGYGKVF106 QVRKVTGANT116 GKIFAMKVLK126 KAMIVRNAKD136 TAHTKAERNI 146 LEEVKHPFIV156 DLIYAFQTGG166 KLYLILEYLS176 GGELFMQLER186 EGIFMEDTAC 196 FYLAEISMAL206 GHLHQKGIIY216 RDLKPENIML226 NHQGHVKLTD236 FGLCKECGTI 257 EYMAPEILMR267 SGHNRAVDWW277 SLGALMYDML287 TGAPPFTGEN297 RKKTIDKILK 307 CKLNLPPYLT317 QEARDLLKKL327 LKRNAASRLG337 AGPGDAGEVQ347 AHPFFRHINW 357 EELLARKVEP367 PFKPLLQSEE377 DVSQFDSKFT387 RQPVDPNQVF408 LGFEYVAPSV 418
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| PDB ID: 7N91 P70 S6K1 IN COMPLEX WITH MSC2317067A-1 | ||||||
| Method | X-ray diffraction | Resolution | 3.00 Å | Mutation | Yes | [1] |
| PDB Sequence |
KIRPECFELL
94 RVLGKGGYGK104 VFQVRKVNTG117 KIFAMKVLKK127 AMIVRNAKDT137 AHTKAERNIL 147 EEVKHPFIVD157 LIYAFQTGGK167 LYLILEYLSG177 GELFMQLERE187 GIFMEDTACF 197 YLAEISMALG207 HLHQKGIIYR217 DLKPENIMLN227 HQGHVKLTDF237 GLGTIEYMAP 262 EILMRSGHNR272 AVDWWSLGAL282 MYDMLTGAPP292 FTGENRKKTI302 DKILKCKLNL 312 PPYLTQEARD322 LLKKLLKRNA332 ASRLGAGPGD342 AGEVQAHPFF352 RHINWEELLA 362 RKVEPPFKPL372 LQSEEDVSQF382 DSKFTRQPVD393 PNQVFLGFEY413 VAPSV |
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Identification of Clinical Candidate M2698, a Dual p70S6K and Akt Inhibitor, for Treatment of PAM Pathway-Altered Cancers. J Med Chem. 2021 Oct 14;64(19):14603-14619. | ||||
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