Structure of PDB 3coh Chain A

Receptor sequence
>3cohA (length=247) Species: 9606 (Homo sapiens) [Search protein sequence]
WALEDFEIGRPLGKGKFGNVYLAREKNSKFILALKVLFKAQLEKAGVEHQ
LRREVEIQSHLRHPNILRLYGYFHDSTRVYLILEYAPLGTVYRELQKLSK
FDEQRTATYITELANALSYCHSKKVIHRDIKPENLLLGSAGELKIADLCG
TLDYLPPEMIEGRMHDEKVDLWSLGVLCYEFLVGKPPFEANTYQDTYKRI
SRVEFTFPDFVTEGARDLISRLLKHNPSQRPMLREVLEHPWITANSS
3D structure
PDB3coh A pentacyclic aurora kinase inhibitor (AKI-001) with high in vivo potency and oral bioavailability.
ChainA
Resolution2.7 Å
3D
structure
Catalytic site residues are labeled in the structure
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Enzymatic activity
Catalytic site (original residue number in PDB) D256 K258 E260 N261 D274 T292
Catalytic site (residue number reindexed from 1) D129 K131 E133 N134 D147 T151
Enzyme Commision number 2.7.11.1: non-specific serine/threonine protein kinase.
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 83H A L139 V147 A160 L194 Y212 A213 P214 G216 L263 L12 V20 A33 L67 Y85 A86 P87 G89 L136 PDBbind-CN: -logKd/Ki=8.40,IC50=4nM
Gene Ontology
Molecular Function
GO:0004672 protein kinase activity
GO:0005524 ATP binding
Biological Process
GO:0006468 protein phosphorylation

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Molecular Function
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Biological Process
External links
PDB RCSB:3coh, PDBe:3coh, PDBj:3coh
PDBsum3coh
PubMed18630890
UniProtO14965|AURKA_HUMAN Aurora kinase A (Gene Name=AURKA)

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