Structure of PDB 3iil Chain A Binding Site BS02

Receptor Information
>3iil Chain A (length=175) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PEFMLLPNILLTGTPGVGKTTLGKELASKSGLKYINVGDLAREEQLYDGY
DEEYDCPILDEDRVVDELDNQMREGGVIVDYHGCDFFPERWFHIVFVLRT
DTNVLYERLETRGYNEKKLTDNIQCEIFQVLYEEATASYKEEIVHQLPSN
KPEELENNVDQILKWIEQWIKDHNS
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 chain3iil Chain A Residue 175 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3iil hCINAP is an atypical mammalian nuclear adenylate kinase with an ATPase motif: Structural and functional studies.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		P-2 E-1
Binding residue
(residue number reindexed from 1)		P1 E2
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.4.3: adenylate kinase.
Gene Ontology
Molecular Function
GO:0004017 adenylate kinase activity
GO:0005515 protein binding
GO:0005524 ATP binding
GO:0016301 kinase activity
GO:0016887 ATP hydrolysis activity
GO:0050145 nucleoside monophosphate kinase activity
Biological Process
GO:0006364 rRNA processing
GO:0015949 nucleobase-containing small molecule interconversion
GO:0016310 phosphorylation
GO:0042254 ribosome biogenesis
GO:0042274 ribosomal small subunit biogenesis
GO:0046940 nucleoside monophosphate phosphorylation
Cellular Component
GO:0005634 nucleus
GO:0005654 nucleoplasm
GO:0005730 nucleolus
GO:0005737 cytoplasm
GO:0005813 centrosome
GO:0015030 Cajal body
GO:0016020 membrane
GO:0016607 nuclear speck

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:3iil, PDBe:3iil, PDBj:3iil
PDBsum3iil
PubMed22038794
UniProtQ9Y3D8|KAD6_HUMAN Adenylate kinase isoenzyme 6 (Gene Name=AK6)

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