Structure of PDB 6gua Chain C Binding Site BS02

Receptor Information
>6gua Chain C (length=820) Species: 272623 (Lactococcus lactis subsp. lactis Il1403) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EYNSEAYLKKLDKWWRAATYLGAGMIFLKENPLFSVTGTPIKAENLKANP
IGHWGTVSGQTFLYAHANRLINKYDQKMFYMGGPGHGGQAMVVPSYLDGS
YTEAYPEITQDLEGMSRLFKRFSFPGGIGSHMTAQTPGSLHEGGELGYVL
SHATGAILDQPEQIAFAVVGDGEAETGPLMTSWHSIKFINPKNDGAILPI
LDLNGFKISNPTLFARTSDVDIRKFFEGLGYSPRYIENDDIHDYMAYHKL
AAEVFDKAIEDIHQIQKDAREDNRYQNGEIPAWPIVIARLPKGWGGPRYN
DWSGPKFDGKGMPIEHSFRAHQVPLPLSSKNMGTLPEFVKWMTSYQPETL
FNADGSLKEELRDFAPKGEMRMASNPVTNGGVDSSNLVLPDWQEFANPIS
ENNRGKLLPDTNDNMDMNVLSKYFAEIVKLNPTRFRLFGPDETMSNRFWE
MFKVTNRQWMQVIKNPNDEFISPEGRIIDSQLSEHQAEGWLEGYTLTGRT
GAFASYESFLRVVDSMLTQHFKWIRQAADQKWRHDYPSLNVISTSTVFQQ
DHNGYTHQDPGMLTHLAEKKSDFIRQYLPADGNTLLAVFDRAFQDRSKIN
HIVASKQPRQQWFTKEEAEKLATDGIATIDWASTAKDGEAVDLVFASAGA
EPTIETLAALHLVNEVFPQAKFRYVNVVELGRLQKKKGALNQERELSDEE
FEKYFGPSGTPVIFGFHGYEDLIESIFYQRGHDGLIVHGYREDGDITTTY
DMRVYSELDRFHQAIDAMQVLYVNRKVNQGLAKAFIDRMKRTLVKHFEVT
RNEGVDIPDFTEWVWSDLKK
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 chain6gua Chain C Residue 902 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6gua Crystal structure of a xylulose 5-phosphate phosphoketolase. Insights into the substrate specificity for xylulose 5-phosphate.
Resolution1.95 Å
Binding residue
(original residue number in PDB)		D173 N206 F208
Binding residue
(residue number reindexed from 1)		D171 N204 F206
Annotation score4
Enzymatic activity
Enzyme Commision number 4.1.2.-
Gene Ontology
Molecular Function
GO:0016829 lyase activity
GO:0016832 aldehyde-lyase activity

View graph for
Molecular Function
External links
PDB RCSB:6gua, PDBe:6gua, PDBj:6gua
PDBsum6gua
PubMed31059775
UniProtQ9CFH4|PHK_LACLA Probable phosphoketolase (Gene Name=LL1502)

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