Structure of PDB 6vpi Chain A Binding Site BS02

Receptor Information
>6vpi Chain A (length=278) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SYSYDAPSDFINFSRQWALEDFEIGRPLGKGKFGNVYLAREKQSKFILAL
KVLFKAQLEKAGVEHQLRREVEIQSHLRHPNILRLYGYFHDATRVYLILE
YAPLGTVYRELQKLSKFDEQRTATYITELANALSYVHSKRVIHRNIKPEN
LLLGSAGELKIADFGWSVHAPSSRRTTLCGTLDYLPPEMIEGRMHDEKVD
LWSLGVLVYEFLVGKPPFEANTYQETYKRISRVEFTFPDFVTEGARDLIS
RLLKHNPSQRPMLREVLEHPWITANSSK
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain6vpi Chain A Residue 602 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6vpi Redox priming promotes Aurora A activation during mitosis.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		N261 D274
Binding residue
(residue number reindexed from 1)		N150 D163
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) N256 K258 E260 N261 D274 T292
Catalytic site (residue number reindexed from 1) N145 K147 E149 N150 D163 T181
Enzyme Commision number 2.7.11.1: non-specific serine/threonine protein kinase.
Gene Ontology
Molecular Function
GO:0004672 protein kinase activity
GO:0005524 ATP binding
Biological Process
GO:0006468 protein phosphorylation

View graph for
Molecular Function
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Biological Process
External links
PDB RCSB:6vpi, PDBe:6vpi, PDBj:6vpi
PDBsum6vpi
PubMed32694171
UniProtO14965|AURKA_HUMAN Aurora kinase A (Gene Name=AURKA);
Q9ULW0

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