Binding Site Information of Target
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T97592 | Target Info | |||
| Target Name | Aurora kinase C (AURKC) | ||||
| Synonyms | Serine/threonine-protein kinase aurora-C; STK13; Aurora/Ipl1/Eg2 protein 2; Aurora/Ipl1-related kinase 3; Aurora-related kinase 3; Aurora-C; Aurora 3; ARK3; ARK-3; AIRK3; AIK3; AIE2 | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | AURKC | ||||
| Biochemical Class | Kinase | ||||
| UniProt ID | |||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| Ligand Name: VX-680 | Ligand Info | |||||
| Structure Description | Human AURKC INCENP complex bound to VX-680 | PDB:6GR9 | ||||
| Method | X-ray diffraction | Resolution | 2.25 Å | Mutation | No | [1] |
| PDB Sequence |
RLVDDFEIGR
47 PLGKGKFGNV57 YLARLKESHF67 IVALKVLFKS77 QIEKEGLEHQ87 LRREIEIQAH 97 LQHPNILRLY107 NYFHDARRVY117 LILEYAPRGE127 LYKELQKSDK137 LDEQRTATII 147 EELADALTYC157 HDKKVIHRDI167 KPENLLLGFR177 GEVKIADFGW187 SVHTPSLRRK 197 MCGTLDYLPP208 EMIEGRTYDE218 KVDLWCIGVL228 CYELLVGYPP238 FESASHSETY 248 RRILKVDVRF258 PLSMPLGARD268 LISRLLRYQP278 LERLPLAQIL288 KHPWVQAHSR 298 RVLPPCA
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| Ligand Name: L-serine-O-phosphate | Ligand Info | |||||
| Structure Description | Human AURKC INCENP complex bound to BRD-7880 | PDB:6GR8 | ||||
| Method | X-ray diffraction | Resolution | 1.75 Å | Mutation | No | [2] |
| PDB Sequence |
GANSRRLVDD
42 FEIGRPLGKG52 KFGNVYLARL62 KESHFIVALK72 VLFKSQIEKE82 GLEHQLRREI 92 EIQAHLQHPN102 ILRLYNYFHD112 ARRVYLILEY122 APRGELYKEL132 QKSDKLDEQR 142 TATIIEELAD152 ALTYCHDKKV162 IHRDIKPENL172 LLGFRGEVKI182 ADFGWSVHTP 192 SLRRKMCGTL203 DYLPPEMIEG213 RTYDEKVDLW223 CIGVLCYELL233 VGYPPFESAS 243 HSETYRRILK253 VDVRFPLSMP263 LGARDLISRL273 LRYQPLERLP283 LAQILKHPWV 293 QAHSRRVLPP303
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| Click to View More Binding Site Information of This Target and Ligand Pair | ||||||
| Ligand Name: Phosphonothreonine | Ligand Info | |||||
| Structure Description | Human AURKC INCENP complex bound to BRD-7880 | PDB:6GR8 | ||||
| Method | X-ray diffraction | Resolution | 1.75 Å | Mutation | No | [2] |
| PDB Sequence |
GANSRRLVDD
42 FEIGRPLGKG52 KFGNVYLARL62 KESHFIVALK72 VLFKSQIEKE82 GLEHQLRREI 92 EIQAHLQHPN102 ILRLYNYFHD112 ARRVYLILEY122 APRGELYKEL132 QKSDKLDEQR 142 TATIIEELAD152 ALTYCHDKKV162 IHRDIKPENL172 LLGFRGEVKI182 ADFGWSVHTP 192 SLRRKMCGTL203 DYLPPEMIEG213 RTYDEKVDLW223 CIGVLCYELL233 VGYPPFESAS 243 HSETYRRILK253 VDVRFPLSMP263 LGARDLISRL273 LRYQPLERLP283 LAQILKHPWV 293 QAHSRRVLPP303
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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:37 or .A:38 or .A:40 or .A:41 or .A:42 or .A:43 or .A:90 or .A:110 or .A:165 or .A:187 or .A:189 or .A:196 or .A:197 or .A:199 or .A:200 or .A:210 or .A:216; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| Click to View More Binding Site Information of This Target and Ligand Pair | ||||||
| Ligand Name: 1-[(2~{R},3~{S})-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-3-methyl-6-oxidanylidene-5-[(2~{S})-1-oxidanylpropan-2-yl]-3,4-dihydro-2~{H}-1,5-benzoxazocin-8-yl]-3-(4-methoxyphenyl)urea | Ligand Info | |||||
| Structure Description | Human AURKC INCENP complex bound to BRD-7880 | PDB:6GR8 | ||||
| Method | X-ray diffraction | Resolution | 1.75 Å | Mutation | No | [2] |
| PDB Sequence |
GANSRRLVDD
42 FEIGRPLGKG52 KFGNVYLARL62 KESHFIVALK72 VLFKSQIEKE82 GLEHQLRREI 92 EIQAHLQHPN102 ILRLYNYFHD112 ARRVYLILEY122 APRGELYKEL132 QKSDKLDEQR 142 TATIIEELAD152 ALTYCHDKKV162 IHRDIKPENL172 LLGFRGEVKI182 ADFGWSVHTP 192 SLRRKMCGTL203 DYLPPEMIEG213 RTYDEKVDLW223 CIGVLCYELL233 VGYPPFESAS 243 HSETYRRILK253 VDVRFPLSMP263 LGARDLISRL273 LRYQPLERLP283 LAQILKHPWV 293 QAHSRRVLPP303
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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 .F8Z or .F8Z2 or .F8Z3 or :3F8Z;style chemicals stick;color identity;select .A:49 or .A:50 or .A:51 or .A:52 or .A:53 or .A:54 or .A:57 or .A:70 or .A:72 or .A:74 or .A:79 or .A:84 or .A:87 or .A:88 or .A:91 or .A:104 or .A:118 or .A:120 or .A:121 or .A:122 or .A:123 or .A:126 or .A:127 or .A:170 or .A:171 or .A:172 or .A:173 or .A:183 or .A:184 or .A:185 or .A:186; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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LEU49
3.639
GLY50
3.739
LYS51
3.321
GLY52
3.233
LYS53
2.978
PHE54
3.542
VAL57
3.588
ALA70
3.463
LYS72
2.647
LEU74
3.707
ILE79
3.546
LEU84
3.538
GLN87
3.707
LEU88
3.150
GLU91
3.085
LEU104
3.886
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | AURKC INCENP complex bound to BRD-7880 | ||||
| REF 2 | AURKC INCENP complex bound to BRD-7880 | ||||
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