Structure of PDB 2a5z Chain A Binding Site BS01

Receptor Information
>2a5z Chain A (length=239) Species: 211586 (Shewanella oneidensis MR-1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TTPGLMSPSEKLKLSTLTTSIATSDFYASYDFMMHSIGLTSANNISLLST
GNISLQNILSEGNHFGVQPIVSSTTANASFLAGMLMAIFPKESELEVTVY
FKTPSAFNPAQLTVIGSTSIGLGISDRSGLIIENGNAFGGIVKASAATET
GSTYALSTSTWYICKFKMLTDDRFKVTLYSDSGTQLYSYTSTAAMFRADN
ATAHIGFKTQCKTATAGISLISIDLIEFKAKVSATRAKV
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 chain2a5z Chain A Residue 701 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2a5z Structure of SO2946 orphan from Shewanella oneidensis shows "jelly-roll" fold with carbohydrate-binding module.
Resolution2.015 Å
Binding residue
(original residue number in PDB)		D54 F88 G89 D247
Binding residue
(residue number reindexed from 1)		D31 F65 G66 D224
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003674 molecular_function
GO:0046872 metal ion binding
Biological Process
GO:0008150 biological_process
Cellular Component
GO:0005575 cellular_component

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:2a5z, PDBe:2a5z, PDBj:2a5z
PDBsum2a5z
PubMed18566914
UniProtQ8ED25

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