Structure of PDB 3zxt Chain A Binding Site BS02

Receptor Information
>3zxt Chain A (length=249) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ENVDDYYDTGEELGSGQFAVVKKCREKSTGLQYAAKFIKKRRTREDIERE
VSILKEIQHPNVITLHEVYENKTDVILILELVAGGELFDFLAEKESLTEE
EATEFLKQILNGVYYLHSLQIAHFDLKPENIMLLDRVPKPRIKIIDFGLA
HKIDEFVAPEIVNYEPLGLEADMWSIGVITYILLSGASPFLGDTKQETLA
NVSAVNYEFEDEYFSNTSALAKDFIRRLLVKDPKKRMTIQDSLQHPWIK
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 chain3zxt Chain A Residue 1278 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3zxt A Journey Through the Dap Kinase Architecture
Resolution2.65 Å
Binding residue
(original residue number in PDB)		N144 D161
Binding residue
(residue number reindexed from 1)		N130 D146
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) D139 K141 E143 N144 D161
Catalytic site (residue number reindexed from 1) D125 K127 E129 N130 D146
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

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Molecular Function
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Biological Process
External links
PDB RCSB:3zxt, PDBe:3zxt, PDBj:3zxt
PDBsum3zxt
PubMed
UniProtP53355|DAPK1_HUMAN Death-associated protein kinase 1 (Gene Name=DAPK1)

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