Brand  (β version)

PDB ID: 4DHF

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Ligands
Code Name Style Show Link
0K6 7-cyclopentyl-2-({1-methyl-5-[(4-methylpiperazin-1-yl)carbonyl]-1h-pyrrol-3-yl}amino)-7h-pyrrolo[2,3-D]pyrimidine-6-carboxamide PoSSuM
PO4 Phosphate ion PoSSuM
MG Magnesium ion PoSSuM
Non-standard Residues
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Structure summary

Code : 4DHF   PDBj   RCSB PDB   PDBe
Header : transferase/transferase inhibitor
Title : Structure of Aurora A mutant bound to Biogenidec cpd 15
Release Data : 2012-07-18
Compound :
mol_id molecule chains synonym
1 Aurora kinase A A,B Aurora 2, Aurora/IPL1-related kinase 1, ARK-1, Aurora-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
fragment: unp residues 126-391
mutation: T287D, T288D
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Spodoptera frugiperda  (taxid:7108)
gene: AIK, AIRK1, ARK1, AURA, AURKA, AuroraA, AYK1, BTAK, IAK1, STK15, STK6
Authors : Silvian, L., Marcotte, D.J.
Keywords : Ser/Thr kinase mitotic kinase pyrazolopyrimidine, phosphorylation, TPX2, transferase-transferase inhibitor complex
Exp. method : X-RAY DIFFRACTION ( 2.80 Å )
Citation :

Structure-based design of 2,6,7-trisubstituted-7H-pyrrolo[2,3-d]pyrimidines as Aurora kinases inhibitors.

Le Brazidec, J.Y.,Pasis, A.,Tam, B.  et al.
(2012)  Bioorg.Med.Chem.Lett.  22 : 4033 - 4037

PubMed: 22607669
DOI: 10.1016/j.bmcl.2012.04.085

Reaction

Chain : A, B
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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