Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T87675 | Target Info | |||
| Target Name | Aurora kinase A (AURKA) | ||||
| Synonyms | hARK1; Serine/threonine-protein kinase aurora-A; Serine/threonine-protein kinase 6; Serine/threonine-protein kinase 15; Serine/threonine kinase 15; STK6; STK15; IAK1; Breast tumor-amplified kinase; BTAK; Aurora/IPL1-related kinase 1; Aurora-related kinase 1; Aurora-A; Aurora 2; AYK1; AURA; ARK1; ARK-1; AIRK1; AIK | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | AURKA | ||||
| Biochemical Class | Kinase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Phosphonothreonine | Ligand Info | |||
| Canonical SMILES | CC(C(C(=O)O)N)OP(=O)(O)O | ||||
| InChI | 1S/C4H10NO6P/c1-2(3(5)4(6)7)11-12(8,9)10/h2-3H,5H2,1H3,(H,6,7)(H2,8,9,10)/t2-,3+/m1/s1 | ||||
| InChIKey | USRGIUJOYOXOQJ-GBXIJSLDSA-N | ||||
| PubChem Compound ID | 3246323 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 5L8L Aurora-A kinase domain in complex with vNAR-D01 (crystal form 1) | ||||||
| Method | X-ray diffraction | Resolution | 1.67 Å | Mutation | Yes | [1] |
| PDB Sequence |
RQWALEDFEI
135 GRPLGKGKFG145 NVYLAREKQS155 KFILALKVLF165 KAQLEKAGVE175 HQLRREVEIQ 185 SHLRHPNILR195 LYGYFHDATR205 VYLILEYAPL215 GTVYRELQKL225 SKFDEQRTAT 235 YITELANALS245 YCHSKRVIHR255 DIKPENLLLG265 SAGELKIADF275 GWSVHAPSSR 285 RTLAGTLDYL296 PPEMIEGRMH306 DEKVDLWSLG316 VLCYEFLVGK326 PPFEANTYQE 336 TYKRISRVEF346 TFPDFVTEGA356 RDLISRLLKH366 NPSQRPMLRE376 VLEHPWITAN 386 SSK
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| PDB ID: 5G1X Crystal structure of Aurora-A kinase in complex with N-Myc | ||||||
| Method | X-ray diffraction | Resolution | 1.72 Å | Mutation | Yes | [2] |
| PDB Sequence |
RQWALEDFEI
135 GRPLGKGKFG145 NVYLAREKQS155 KFILALKVLF165 KAQLEKAGVE175 HQLRREVEIQ 185 SHLRHPNILR195 LYGYFHDATR205 VYLILEYAPL215 GTVYRELQKL225 SKFDEQRTAT 235 YITELANALS245 YCHSKRVIHR255 DIKPENLLLG265 SAGELKIADF275 GWSVHAPSSR 285 RTLAGTLDYL296 PPEMIEGRMH306 DEKVDLWSLG316 VLCYEFLVGK326 PPFEANTYQE 336 TYKRISRVEF346 TFPDFVTEGA356 RDLISRLLKH366 NPSQRPMLRE376 VLEHPWITAN 386 SSK
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| PDB ID: 5L8K Aurora-A kinase domain in complex with vNAR-D01 (crystal form 2) | ||||||
| Method | X-ray diffraction | Resolution | 1.79 Å | Mutation | Yes | [1] |
| PDB Sequence |
RQWALEDFEI
135 GRPLGKGKFG145 NVYLAREKQS155 KFILALKVLF165 KAQLEKAGVE175 HQLRREVEIQ 185 SHLRHPNILR195 LYGYFHDATR205 VYLILEYAPL215 GTVYRELQKL225 SKFDEQRTAT 235 YITELANALS245 YCHSKRVIHR255 DIKPENLLLG265 SAGELKIADF275 GWSVHAPSSR 285 RTLAGTLDYL296 PPEMIEGRMH306 DEKVDLWSLG316 VLCYEFLVGK326 PPFEANTYQE 336 TYKRISRVEF346 TFPDFVTEGA356 RDLISRLLKH366 NPSQRPMLRE376 VLEHPWITAN 386 SSKPSN
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| PDB ID: 6R4A Aurora-A in complex with shape-diverse fragment 55 | ||||||
| Method | X-ray diffraction | Resolution | 1.94 Å | Mutation | Yes | [3] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 6R4D Aurora-A in complex with shape-diverse fragment 58 | ||||||
| Method | X-ray diffraction | Resolution | 2.01 Å | Mutation | Yes | [3] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 6R4C Aurora-A in complex with shape-diverse fragment 57 | ||||||
| Method | X-ray diffraction | Resolution | 2.04 Å | Mutation | Yes | [3] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 4CEG Crystal structure of Aurora A 122-403 C290A, C393A bound to ADP | ||||||
| Method | X-ray diffraction | Resolution | 2.10 Å | Mutation | Yes | [4] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 6R4B Aurora-A in complex with shape-diverse fragment 56 | ||||||
| Method | X-ray diffraction | Resolution | 2.15 Å | Mutation | No | [3] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 2WTV Aurora-A Inhibitor Structure | ||||||
| Method | X-ray diffraction | Resolution | 2.40 Å | Mutation | Yes | [5] |
| PDB Sequence |
KRQWALEDFE
134 IGRPLGKGKF144 GNVYLAREKQ154 SKFILALKVL164 FKAQLEKAGV174 EHQLRREVEI 184 QSHLRHPNIL194 RLYGYFHDAT204 RVYLILEYAP214 RGEVYKELQK224 LSKFDEQRTA 234 TYITELANAL244 SYCHSKRVIH254 RDIKPENLLL264 GSAGELKIAD274 FGWSVHAPSS 284 RRLGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SK
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:143 or .A:279 or .A:280 or .A:281 or .A:285 or .A:286 or .A:289 or .A:291 or .A:292 or .A:293 or .A:334; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 4BN1 Crystal structure of V174M mutant of Aurora-A kinase | ||||||
| Method | X-ray diffraction | Resolution | 2.50 Å | Mutation | Yes | [6] |
| PDB Sequence |
RQWALEDFEI
135 GRPLGKGKFG145 NVYLAREKQS155 KFILALKVLF165 KAQLEKAGME175 HQLRREVEIQ 185 SHLRHPNILR195 LYGYFHDATR205 VYLILEYAPL215 GTVYRELQKL225 SKFDEQRTAT 235 YITELANALS245 YCHSKRVIHR255 DIKPENLLLG265 SAGELKIADF275 GWSVHAPSSR 285 RLCGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 S
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:174 or .A:176 or .A:177 or .A:180 or .A:255 or .A:277 or .A:279 or .A:284 or .A:285 or .A:286 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 6I2U Aurora-A kinase domain in complex with Coenzyme A | ||||||
| Method | X-ray diffraction | Resolution | 2.50 Å | Mutation | No | [7] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 LCGTLDYLPP298 EMIEGRMHDE308 KVDLWSLGVL318 CYEFLVGKPP328 FEANTYQETY 338 KRISRVEFTF348 PDFVTEGARD358 LISRLLKHNP368 SQRPMLREVL378 EHPWITANSS 388 KPS
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:173 or .A:176 or .A:177 or .A:180 or .A:255 or .A:277 or .A:284 or .A:285 or .A:286 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 5LXM Crystal structure of Aurora-A bound to a hydrocarbon-stapled proteomimetic of TPX2 | ||||||
| Method | X-ray diffraction | Resolution | 2.08 Å | Mutation | Yes | [8] |
| PDB Sequence |
RQWALEDFEI
135 GRPLGKGKFG145 NVYLAREKQS155 KFILALKVLF165 KAQLEKAGVE175 HQLRREVEIQ 185 SHLRHPNILR195 LYGYFHDATR205 VYLILEYAPL215 GTVYRELQKL225 SKFDEQRTAT 235 YITELANALS245 YCHSKRVIHR255 DIKPENLLLG265 SAGELKIADF275 GWSVHAPSSR 285 RTLAGTLDYL296 PPEMIEGRMH306 DEKVDLWSLG316 VLCYEFLVGK326 PPFEANTYQE 336 TYKRISRVEF346 TFPDFVTEGA356 RDLISRLLKH366 NPSQRPMLRE376 VLEHPWITAN 386 SSKPSN
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:177 or .A:180 or .A:255 or .A:277 or .A:286 or .A:287 or .A:289 or .A:290 or .A:300 or .A:306; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 1OL5 Structure of Aurora-A 122-403, phosphorylated on Thr287, Thr288 and bound to TPX2 1-43 | ||||||
| Method | X-ray diffraction | Resolution | 2.50 Å | Mutation | No | [9] |
| PDB Sequence |
SKKRQWALED
132 FEIGRPLGKG142 KFGNVYLARE152 KQSKFILALK162 VLFKAQLEKA172 GVEHQLRREV 182 EIQSHLRHPN192 ILRLYGYFHD202 ATRVYLILEY212 APLGTVYREL222 QKLSKFDEQR 232 TATYITELAN242 ALSYCHSKRV252 IHRDIKPENL262 LLGSAGELKI272 ADFGWSVHAP 282 SSRRLCGTLD294 YLPPEMIEGR304 MHDEKVDLWS314 LGVLCYEFLV324 GKPPFEANTY 334 QETYKRISRV344 EFTFPDFVTE354 GARDLISRLL364 KHNPSQRPML374 REVLEHPWIT 384 ANSS
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:180 or .A:255 or .A:285 or .A:286 or .A:289 or .A:290 or .A:300 or .A:304 or .A:305 or .A:306; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 1OL7 Structure of Human Aurora-A 122-403 phosphorylated on Thr287, Thr288 | ||||||
| Method | X-ray diffraction | Resolution | 2.75 Å | Mutation | No | [9] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 LCGTLDYLPP298 EMIEGRMHDE308 KVDLWSLGVL318 CYEFLVGKPP328 FEANTYQETY 338 KRISRVEFTF348 PDFVTEGARD358 LISRLLKHNP368 SQRPMLREVL378 EHPWITANSS 388 KP
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 2W1C Structure determination of Aurora Kinase in complex with inhibitor | ||||||
| Method | X-ray diffraction | Resolution | 3.24 Å | Mutation | No | [10] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 LCGTLDYLPP298 EMIEGRMHDE308 KVDLWSLGVL318 CYEFLVGKPP328 FEANTYQETY 338 KRISRVEFTF348 PDFVTEGARD358 LISRLLKHNP368 SQRPMLREVL378 EHPWITANSS 388 KH
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:289 or .A:290 or .A:291; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 5DT3 Aurora A Kinase in Complex with ATP in Space Group P6122 | ||||||
| Method | X-ray diffraction | Resolution | 2.33 Å | Mutation | No | [11] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLCGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKP
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:174 or .A:176 or .A:177 or .A:180 or .A:255 or .A:277 or .A:284 or .A:285 or .A:286 or .A:288 or .A:289; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 5DNR Aurora A Kinase in complex with ATP in space group P41212 | ||||||
| Method | X-ray diffraction | Resolution | 1.95 Å | Mutation | No | [11] |
| PDB Sequence |
RQWALEDFEI
135 GRPLGKGKFG145 NVYLAREKQS155 KFILALKVLF165 KAQLEKAGVE175 HQLRREVEIQ 185 SHLRHPNILR195 LYGYFHDATR205 VYLILEYAPL215 GTVYRELQKL225 SKFDEQRTAT 235 YITELANALS245 YCHSKRVIHR255 DIKPENLLLG265 SAGELKIADF275 GWSVHAPSSR 285 RTLCGTLDYL296 PPEMIEGRMH306 DEKVDLWSLG316 VLCYEFLVGK326 PPFEANTYQE 336 TYKRISRVEF346 TFPDFVTEGA356 RDLISRLLKH366 NPSQRPMLRE376 VLEHPWITAN 386 SSKP
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:143 or .A:277 or .A:286 or .A:287 or .A:289 or .A:290 or .A:291 or .A:292 or .A:296 or .A:334; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 5DN3 Aurora A in complex with ATP and AA35. | ||||||
| Method | X-ray diffraction | Resolution | 2.05 Å | Mutation | No | [11] |
| PDB Sequence |
KRQWALEDFE
134 IGRPLGKGKF144 GNVYLAREKQ154 SKFILALKVL164 FKAQLEKAGV174 EHQLRREVEI 184 QSHLRHPNIL194 RLYGYFHDAT204 RVYLILEYAP214 LGTVYRELQK224 LSKFDEQRTA 234 TYITELANAL244 SYCHSKRVIH254 RDIKPENLLL264 GSAGELKIAD274 FGWSVHAPSS 284 RRTLCGTLDY295 LPPEMIEGRM305 HDEKVDLWSL315 GVLCYEFLVG325 KPPFEANTYQ 335 ETYKRISRVE345 FTFPDFVTEG355 ARDLISRLLK365 HNPSQRPMLR375 EVLEHPWITA 385 NSSK
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:143 or .A:258 or .A:277 or .A:286 or .A:287 or .A:289 or .A:290 or .A:291 or .A:292 or .A:296 or .A:334; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 5EW9 Crystal Structure of Aurora A Kinase Domain Bound to MK-5108 | ||||||
| Method | X-ray diffraction | Resolution | 2.18 Å | Mutation | No | [12] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHRLCGTL 293 DYLPPEMIEG303 RMHDEKVDLW313 SLGVLCYEFL323 VGKPPFEANT333 YQETYKRISR 343 VEFTFPDFVT353 EGARDLISRL363 LKHNPSQRPM373 LREVLEHPWI383 TANSSKP |
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:173 or .A:177 or .A:279 or .A:280 or .A:286 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 5OS5 Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.74 Å | Mutation | No | [13] |
| PDB Sequence |
KRQWALEDFE
134 IGRPLGKGKF144 GNVYLAREKQ154 SKFILALKVL164 FKAQLEKAGV174 EHQLRREVEI 184 QSHLRHPNIL194 RLYGYFHDAT204 RVYLILEYAP214 LGTVYRELQK224 LSKFDEQRTA 234 TYITELANAL244 SYCHSKRVIH254 RDIKPENLLL264 GSAGELKIAD274 FGWSVHAPSS 284 RRTLAGTLDY295 LPPEMIEGRM305 HDEKVDLWSL315 GVLCYEFLVG325 KPPFEANTYQ 335 ETYKRISRVE345 FTFPDFVTEG355 ARDLISRLLK365 HNPSQRPMLR375 EVLEHPWITA 385 NSSKPSN
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 3E5A Crystal structure of Aurora A in complex with VX-680 and TPX2 | ||||||
| Method | X-ray diffraction | Resolution | 2.30 Å | Mutation | No | [14] |
| PDB Sequence |
KRQWALEDFE
134 IGRPLGKGKF144 GNVYLAREKQ154 SKFILALKVL164 FKAQLEKAGV174 EHQLRREVEI 184 QSHLRHPNIL194 RLYGYFHDAT204 RVYLILEYAP214 LGTVYRELQK224 LSKFDEQRTA 234 TYITELANAL244 SYCHSKRVIH254 RDIKPENLLL264 GSAGELKIAD274 FGWSVHAPSS 284 RRTLCGTLDY295 LPPEMIEGRM305 HDEKVDLWSL315 GVLCYEFLVG325 KPPFEANTYQ 335 ETYKRISRVE345 FTFPDFVTEG355 ARDLISRLLK365 HNPSQRPMLR375 EVLEHPWITA 385 NSSK
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:180 or .A:255 or .A:277 or .A:279 or .A:286 or .A:287 or .A:289 or .A:290 or .A:300 or .A:306; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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||||||
| PDB ID: 3HA6 Crystal structure of aurora A in complex with TPX2 and compound 10 | ||||||
| Method | X-ray diffraction | Resolution | 2.36 Å | Mutation | No | [15] |
| PDB Sequence |
GKRQWALEDF
133 EIGRPLGKGK143 FGNVYLAREK153 QSKFILALKV163 LFKAQLEKAG173 VEHQLRREVE 183 IQSHLRHPNI193 LRLYGYFHDA203 TRVYLILEYA213 PLGTVYRELQ223 KLSKFDEQRT 233 ATYITELANA243 LSYCHSKRVI253 HRDIKPENLL263 LGSAGELKIA273 DFGWSVHAPS 283 SRRLCGTLDY295 LPPEMIEGRM305 HDEKVDLWSL315 GVLCYEFLVG325 KPPFEANTYQ 335 ETYKRISRVE345 FTFPDFVTEG355 ARDLISRLLK365 HNPSQRPMLR375 EVLEHPWITA 385 NSS
|
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:180 or .A:255 or .A:277 or .A:279 or .A:285 or .A:286 or .A:289 or .A:290 or .A:300 or .A:305 or .A:306; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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||||||
| PDB ID: 5OSD Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.99 Å | Mutation | No | [13] |
| PDB Sequence |
KRQWALEDFE
134 IGRPLGKGKF144 GNVYLAREKQ154 SKFILALKVL164 FKAQLEKAGV174 EHQLRREVEI 184 QSHLRHPNIL194 RLYGYFHDAT204 RVYLILEYAP214 LGTVYRELQK224 LSKFDEQRTA 234 TYITELANAL244 SYCHSKRVIH254 RDIKPENLLL264 GSAGELKIAD274 FGWSVHAPSS 284 RRTLAGTLDY295 LPPEMIEGRM305 HDEKVDLWSL315 GVLCYEFLVG325 KPPFEANTYQ 335 ETYKRISRVE345 FTFPDFVTEG355 ARDLISRLLK365 HNPSQRPMLR375 EVLEHPWITA 385 NSSKPS
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|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORL Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.69 Å | Mutation | Yes | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
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|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5OS0 Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.74 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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||||||
| PDB ID: 5OS3 Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.81 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
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|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORV Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.88 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
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|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORX Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.88 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5OS4 Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.88 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5OSF Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.89 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5OS1 Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.90 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5OSE Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.90 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORZ Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.92 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORS Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.98 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORY Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 1.99 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORW Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 2.00 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORR Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 2.09 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORO Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 2.12 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORN Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 2.19 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5ORP Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 2.19 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| PDB ID: 5OS6 Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 2.20 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .TPO or .TPO2 or .TPO3 or :3TPO;style chemicals stick;color identity;select .A:172 or .A:277 or .A:285 or .A:286 or .A:287 or .A:289 or .A:290; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 5ORT Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | ||||||
| Method | X-ray diffraction | Resolution | 2.56 Å | Mutation | No | [13] |
| PDB Sequence |
QWALEDFEIG
136 RPLGKGKFGN146 VYLAREKQSK156 FILALKVLFK166 AQLEKAGVEH176 QLRREVEIQS 186 HLRHPNILRL196 YGYFHDATRV206 YLILEYAPLG216 TVYRELQKLS226 KFDEQRTATY 236 ITELANALSY246 CHSKRVIHRD256 IKPENLLLGS266 AGELKIADFG276 WSVHAPSSRR 286 TLAGTLDYLP297 PEMIEGRMHD307 EKVDLWSLGV317 LCYEFLVGKP327 PFEANTYQET 337 YKRISRVEFT347 FPDFVTEGAR357 DLISRLLKHN367 PSQRPMLREV377 LEHPWITANS 387 SKPS
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Click to Show 3D Structure of This Binding Site
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Allosteric inhibition of Aurora-A kinase by a synthetic vNAR domain. Open Biol. 2016 Jul;6(7):160089. | ||||
| REF 2 | Structural basis of N-Myc binding by Aurora-A and its destabilization by kinase inhibitors. Proc Natl Acad Sci U S A. 2016 Nov 29;113(48):13726-13731. | ||||
| REF 3 | Construction of a Shape-Diverse Fragment Set: Design, Synthesis and Screen against Aurora-A Kinase. Chemistry. 2019 May 10;25(27):6831-6839. | ||||
| REF 4 | The structure of C290A:C393A Aurora A provides structural insights into kinase regulation. Acta Crystallogr F Struct Biol Commun. 2015 Mar;71(Pt 3):315-9. | ||||
| REF 5 | Crystal structure of an Aurora-A mutant that mimics Aurora-B bound to MLN8054: insights into selectivity and drug design. Biochem J. 2010 Mar 15;427(1):19-28. | ||||
| REF 6 | Insights into Aurora-A kinase activation using unnatural amino acids incorporated by chemical modification. ACS Chem Biol. 2013 Oct 18;8(10):2184-91. | ||||
| REF 7 | Covalent Aurora A regulation by the metabolic integrator coenzyme A. Redox Biol. 2020 Jan;28:101318. | ||||
| REF 8 | A TPX2 Proteomimetic Has Enhanced Affinity for Aurora-A Due to Hydrocarbon Stapling of a Helix. ACS Chem Biol. 2016 Dec 16;11(12):3383-3390. | ||||
| REF 9 | Structural basis of Aurora-A activation by TPX2 at the mitotic spindle. Mol Cell. 2003 Oct;12(4):851-62. | ||||
| REF 10 | Fragment-based discovery of the pyrazol-4-yl urea (AT9283), a multitargeted kinase inhibitor with potent aurora kinase activity. J Med Chem. 2009 Jan 22;52(2):379-88. | ||||
| REF 11 | Allosteric modulation of AURKA kinase activity by a small-molecule inhibitor of its protein-protein interaction with TPX2. Sci Rep. 2016 Jun 24;6:28528. | ||||
| REF 12 | A Cell Biologist's Field Guide to Aurora Kinase Inhibitors. Front Oncol. 2015 Dec 21;5:285. | ||||
| REF 13 | Characterization of Three Druggable Hot-Spots in the Aurora-A/TPX2 Interaction Using Biochemical, Biophysical, and Fragment-Based Approaches. ACS Chem Biol. 2017 Nov 17;12(11):2906-2914. | ||||
| REF 14 | Modulation of kinase-inhibitor interactions by auxiliary protein binding: crystallography studies on Aurora A interactions with VX-680 and with TPX2. Protein Sci. 2008 Oct;17(10):1791-7. | ||||
| REF 15 | Design, synthesis and selection of DNA-encoded small-molecule libraries. Nat Chem Biol. 2009 Sep;5(9):647-54. | ||||
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