Brand  (β version)

PDB ID: 5OBR

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Ligands
Code Name Style Show Link
9QT 2-(3-chloranyl-5-fluoranyl-phenyl)quinoline-4-carboxylic acid PoSSuM
MG Magnesium ion PoSSuM
SKE 4-({5-amino-1-[(2,6-difluorophenyl)carbonyl]-1h-1,2,4-triazol-3-yl}amino)benzenesulfonamide PoSSuM
Non-standard Residues
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Glycosylation
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Structure summary

Code : 5OBR   PDBj   RCSB PDB   PDBe
Header : CELL CYCLE
Title : Aurora A kinase in complex with 2-(3-chloro-5-fluorophenyl)quinoline-4-carboxylic acid and JNJ-7706621
Release Data : 2017-08-09
Compound :
mol_id molecule chains synonym
1 Aurora kinase A A Aurora 2,Aurora/IPL1-related kinase 1,hARK1,Breast tumor-amplified kinase,Serine/threonine-protein kinase 15,Serine/threonine-protein kinase 6,Serine/threonine-protein kinase aurora-A
ec: 2.7.11.1
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli BL21(DE3)  (taxid:469008)
gene: AURKA, AIK, AIRK1, ARK1, AURA, AYK1, BTAK, IAK1, STK15, STK6
expression_system_variant: pUBS520
expression_system_plasmid: pHAT4
Authors : Rossmann, M., Janecek, M., Hyvonen, M.
Keywords : inhibitor, kinase, allostery, protein-protein interface, CELL CYCLE
Exp. method : X-RAY DIFFRACTION ( 2.620 Å )
Citation :

Computationally-guided optimization of small-molecule inhibitors of the Aurora A kinase-TPX2 protein-protein interaction.

Cole, D.J.,Janecek, M.,Stokes, J.E.  et al.
(2017)  Chem. Commun. (Camb.)  53 : 9372 - 9375

PubMed: 28787041
DOI: 10.1039/c7cc05379g

Allosteric modulation of AURKA kinase activity by a small-molecule inhibitor of its protein-protein interaction with TPX2.

Janecek, M.,Rossmann, M.,Sharma, P.  et al.
(2016)  Sci Rep  6 : 28528

PubMed: 27339427
DOI: 10.1038/srep28528

Reaction

Chain : A
UniProt : O14965 (AURKA_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
ATP + L-seryl-[protein] = ADP + H(+) + O-phospho-L-seryl- [protein] 2.7.11.1 PubMed:12237287, PubMed:16337122, PubMed:19140666, PubMed:19402633, PubMed:27837025, PubMed:28218735
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ATP + L-threonyl-[protein] = ADP + H(+) + O-phospho-L- threonyl-[protein] 2.7.11.1 PubMed:12237287, PubMed:16337122, PubMed:19140666, PubMed:19402633, PubMed:27837025, PubMed:28218735
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