Structure of PDB 3n1e Chain A Binding Site BS01

Receptor Information
>3n1e Chain A (length=140) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DQWSMLRHFDHITKDYHDHIAEISAKLVAIMDSLFDKLLSKYEVKAPVPS
PCFRNICKQMTKMHEAIFDLLPEEQTQMLFLRINASYKLHLKKQLSHLNV
INDGGPQNGLVTADVAFYTGNLQALKGLKDLDLNMAEIWE
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 chain3n1e Chain A Residue 977 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3n1e Structural basis for the wobbler mouse neurodegenerative disorder caused by mutation in the Vps54 subunit of the GARP complex.
Resolution1.702 Å
Binding residue
(original residue number in PDB)		P940 Q941
Binding residue
(residue number reindexed from 1)		P106 Q107
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0042147 retrograde transport, endosome to Golgi
Cellular Component
GO:0000938 GARP complex

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Biological Process
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Cellular Component
External links
PDB RCSB:3n1e, PDBe:3n1e, PDBj:3n1e
PDBsum3n1e
PubMed20615984
UniProtQ5SPW0|VPS54_MOUSE Vacuolar protein sorting-associated protein 54 (Gene Name=Vps54)

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