Structure of PDB 6par Chain B Binding Site BS03

Receptor Information
>6par Chain B (length=584) Species: 279238 (Novosphingobium aromaticivorans DSM 12444) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
WQTLKRFLPYLWPADNAVLRRRVVGAILMVLLGKATTLALPFAYKKAVDA
MTLGGGAQPALTVALAFVLAYALGRFSGVLFDNLRNIVFERVGQDATRHL
AENVFARLHKLSLRFHLARRTGEVTKVIERGTKSIDTMLYFLLFNIAPTV
IELTAVIVIFWLNFGLGLVTATILAVIAYVWTTRTITEWRTHLREKMNRL
DGQALARAVDSLLNYETVKYFGAESREEARYASAARAYADAAVKSENSLG
LLNIAQALIVNLLMAGAMAWTVYGWSQGKLTVGDLVFVNTYLTQLFRPLD
MLGMVYRTIRQGLIDMAEMFRLIDTHIEVADVPNAPALVVNRPSVTFDNV
VFGYDRDREILHGLSFEVAAGSRVAIVGPSGAGKSTIARLLFRFYDPWEG
RILIDGQDIAHVTQTSLRAALGIVPQDSVLFNDTIGYNIAYGRDGASRAE
VDAAAKGAAIADFIARLPQGYDTEVGERGLKLSGGEKQRVAIARTLVKNP
PILLFDEATSALDTRTEQDILSTMRAVASHRTTISIAHRLSTIADSDTIL
VLDQGRLAEQGSHLDLLRRDGLYAEMWARQAAES
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 chain6par Chain B Residue 702 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6par A structural framework for unidirectional transport by a bacterial ABC exporter.
Resolution3.35 Å
Binding residue
(original residue number in PDB)		S401 Q442
Binding residue
(residue number reindexed from 1)		S385 Q426
Annotation score1
Enzymatic activity
Enzyme Commision number 7.-.-.-
Gene Ontology
Molecular Function
GO:0005524 ATP binding
GO:0016887 ATP hydrolysis activity
GO:0042626 ATPase-coupled transmembrane transporter activity
GO:0140359 ABC-type transporter activity
Biological Process
GO:0006811 monoatomic ion transport
GO:0046689 response to mercury ion
GO:0055085 transmembrane transport
Cellular Component
GO:0005886 plasma membrane
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6par, PDBe:6par, PDBj:6par
PDBsum6par
PubMed32703810
UniProtQ2G506|ATM1_NOVAD ATM1-type heavy metal exporter (Gene Name=atm1)

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