Structure of PDB 4bg8 Chain B Binding Site BS01

Receptor Information
>4bg8 Chain B (length=314) Species: 190192 (Methanopyrus kandleri AV19) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LTRVLGIQLGNTGTDYCVMNEDGDWEIVAREEGVFGKISCVFTLEESRRA
LREEIAPRVIERVRRVNPDLAVVGTIVDELGLILGPMIHEKTGVPTLAVY
GDPWGAPDGDAVGAPYCVAEEYPNCVHVDVGAMAVVTPIRDGRPDFGDAV
VSVGTFPLDLAARELLGKEYDEGGKKAAEGEVDENFRRELRSVDVDGKPV
FGRVRGSLAPVPPEQERVLRDHIRDAGAPAEDVLRTLVELVAETIVINAA
QYDMDLLVLSGGGVKNELLKRRVSELWEGDVSIFAGEELEARGLCLLGLR
YLEGEPVPALPCEG
Ligand information
Ligand IDACT
InChIInChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
InChIKeyQTBSBXVTEAMEQO-UHFFFAOYSA-M
SMILES
SoftwareSMILES
ACDLabs 10.04[O-]C(=O)C
OpenEye OEToolkits 1.5.0CC(=O)[O-]
CACTVS 3.341CC([O-])=O
FormulaC2 H3 O2
NameACETATE ION
ChEMBL
DrugBankDB14511
ZINC
PDB chain4bg8 Chain B Residue 1355 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4bg8 Structural Characterization of the Ribonuclease H-Like Type Askha Superfamily Kinase Mk0840 from Methanopyrus Kandleri
Resolution1.96 Å
Binding residue
(original residue number in PDB)		R307 R308 E311
Binding residue
(residue number reindexed from 1)		R271 R272 E275
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0005524 ATP binding
GO:0008237 metallopeptidase activity
GO:0016773 phosphotransferase activity, alcohol group as acceptor
GO:0046872 metal ion binding
Biological Process
GO:0006040 amino sugar metabolic process
GO:0009254 peptidoglycan turnover

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Molecular Function
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Biological Process
External links
PDB RCSB:4bg8, PDBe:4bg8, PDBj:4bg8
PDBsum4bg8
PubMed24311585
UniProtQ8TX37

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