Structure of PDB 3fa5 Chain B Binding Site BS01

Receptor Information
>3fa5 Chain B (length=276) Species: 318586 (Paracoccus denitrificans PD1222) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GKPCIICVAITGSLPTKENNPAVPITLAEQVESTHEAFEAGASIAHCHVR
DDEGRPTSDPDRFAALKEGLERHCPGMIVQLSTGGRSGAGQARGAMLPLC
PDMASLSVGSNNFPTRVYENPPDLVDWLAAEMLKYDIKPEIEAFDLSHIL
QAKRMAGDGRLAGTPYVQFVMGVRNAMPADRDVFDYYIHTVRRLFGEDAP
WCAAGIGPSQIVLNEWAISSGGHARTGLEDNVRLDRDRLAPSNAALVGRA
VELCEKYERPVATWRQARQILGLRMV
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 chain3fa5 Chain B Residue 282 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3fa5 Crystal structure of protein of unknown function (DUF849) (YP_917261.1) from PARACOCCUS DENITRIFICANS PD1222 at 1.90 A resolution
Resolution1.9 Å
Binding residue
(original residue number in PDB)		H51 H53 E234
Binding residue
(residue number reindexed from 1)		H46 H48 E229
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0043720 3-keto-5-aminohexanoate cleavage activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:3fa5, PDBe:3fa5, PDBj:3fa5
PDBsum3fa5
PubMed
UniProtA1B7S1

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