Structure of PDB 5zol Chain G Binding Site BS02

Receptor Information
>5zol Chain G (length=222) Species: 83333 (Escherichia coli K-12) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RSMELYLDTSDVVAVKALSRIFPLAGVTTNPSTIAAGKKPLDVVLPQLHE
AMGGQGRLFATVMATTAEGMVNDALKLRSIIADIVVKVPVTAEGLAAIKM
LKAEGIPTLGTAVYGAAQGLLSALAGAEYVAPYVNRIDAQGGSGIQTVTD
LHQLLKMHAPQAKVLAASFKTPRQALDCLLAGCESITLPLDVAQQMQSYP
AVDAAVAKFEQDWQGAFGRTSI
Ligand information
Ligand IDLW1
InChIInChI=1S/C5H4OS/c6-4-5-2-1-3-7-5/h1-4H
InChIKeyCNUDBTRUORMMPA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385O=Cc1sccc1
ACDLabs 12.01C(c1cccs1)=O
OpenEye OEToolkits 2.0.6c1cc(sc1)C=O
FormulaC5 H4 O S
Namethiophene-2-carbaldehyde
ChEMBLCHEMBL328441
DrugBank
ZINCZINC000000158751
PDB chain5zol Chain G Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5zol The engineering of decameric d-fructose-6-phosphate aldolase A by combinatorial modulation of inter- and intra-subunit interactions.
Resolution2.172 Å
Binding residue
(original residue number in PDB)		D6 R134 S166
Binding residue
(residue number reindexed from 1)		D8 R136 S168
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) P170 R171
Catalytic site (residue number reindexed from 1) P172 R173
Enzyme Commision number 4.1.2.-
Gene Ontology
Molecular Function
GO:0016829 lyase activity
GO:0016832 aldehyde-lyase activity
GO:0042802 identical protein binding
GO:0097023 fructose 6-phosphate aldolase activity
Biological Process
GO:0005975 carbohydrate metabolic process
GO:0006000 fructose metabolic process
GO:0042182 ketone catabolic process
Cellular Component
GO:0005737 cytoplasm

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Biological Process
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Cellular Component
External links
PDB RCSB:5zol, PDBe:5zol, PDBj:5zol
PDBsum5zol
PubMed32519699
UniProtP78055|FSAA_ECOLI Fructose-6-phosphate aldolase 1 (Gene Name=fsaA)

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