Structure of PDB 4uau Chain A Binding Site BS02

Receptor Information
>4uau Chain A (length=226) Species: 1063 (Cereibacter sphaeroides) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MIEAILFDVNGTLAETEELHRRAFNETFAALGVDWFWDREEYRELLTTTG
GKERIARFLRHQKGDPAPLPIADIHRAKTERFVALMAEGEIALRPGIADL
IAEAKRAGIRLAVATTTSLPNVEALCRACFGHPAREIFDVIAAGDMVAEK
KPSPDIYRLALRELDVPPERAVALEDSLNGLRAAKGAGLRCIVSPGFYTR
HEEFAGADRLLDSFAELGGLAGLDLT
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 chain4uau Chain A Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4uau Degradation of potent Rubisco inhibitor by selective sugar phosphatase.
Resolution1.45 Å
Binding residue
(original residue number in PDB)		D8 N10 D176
Binding residue
(residue number reindexed from 1)		D8 N10 D176
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) D8 V9 N10 T16 T47 T115 T116 K151 E175 D176
Catalytic site (residue number reindexed from 1) D8 V9 N10 T16 T47 T115 T116 K151 E175 D176
Enzyme Commision number 3.1.3.-
Gene Ontology
Molecular Function
GO:0000287 magnesium ion binding
GO:0016787 hydrolase activity
GO:0046872 metal ion binding
Biological Process
GO:0005998 xylulose catabolic process

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Molecular Function
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Biological Process
External links
PDB RCSB:4uau, PDBe:4uau, PDBj:4uau
PDBsum4uau
PubMed27246049
UniProtP95649|CBBY_CERSP Protein CbbY (Gene Name=cbbY)

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