Structure of PDB 4u9n Chain B Binding Site BS01

Receptor Information
>4u9n Chain B (length=178) Species: 300852 (Thermus thermophilus HB8) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LVYSEAGPVALWLARVRWLVILILTGMVTSSILQGFESVLEAVTALAFYV
PVLLGTGGNTGNQSATLIIRALATRDLDLRDWRRVFLKEMGVGLLLGLTL
SFLLVGKVYWDGHPLLLPVVGVSLVLIVFFANLVGAMLPFLLRRLGVDPA
LVSNPLVATLSDVTGLLIYLSVARLLLE
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain4u9n Chain B Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4u9n Structural basis for ion selectivity revealed by high-resolution crystal structure of Mg(2+) channel MgtE
Resolution2.2 Å
Binding residue
(original residue number in PDB)		E307 E311
Binding residue
(residue number reindexed from 1)		E37 E41
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008324 monoatomic cation transmembrane transporter activity
Biological Process
GO:0006812 monoatomic cation transport

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Molecular Function
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Biological Process
External links
PDB RCSB:4u9n, PDBe:4u9n, PDBj:4u9n
PDBsum4u9n
PubMed25367295
UniProtQ5SMG8|MGTE_THET8 Magnesium transporter MgtE (Gene Name=mgtE)

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