Structure of PDB 7f1n Chain A Binding Site BS01

Receptor Information
>7f1n Chain A (length=502) Species: 2012527 (Thermofilum sp. ex4484_79) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MPFPEKFFWGASSSGFQFEMGDPEGKSIDPNTDWFKWVHDETNIRRGVVS
GDLPEHGINYWDLFRSDHELAASIGMNAYRIGIEWSRIFPKPTLDVRVGI
ELDPEGYITRVEVDDKAIEELDLLANKEAVSRYREIILDLRDRGLKVFVC
LNHFTLPLWIHDPIACRDTKLKRGPKGWVDKTTILEFAKYSAYMAWSLGN
IVDYWVTFNEPMVVTEAGYFQPEVGFPPGLRNISAFKTACLNIANAHVVA
YDLIKKYDKVRADDDSPSAAYVGIVHNIVPIKPYSERKLDLKAADLMNYI
HNKWILEFIVRGKIDRSLVGREKYLIDKFKDKLDWLGVNYYTRIVLKGKW
VPVIPDIVKGYGFNCTPGGRSLDGMPVSDFGWEVYPQGLSDALDIASEYG
KPLIVTENGIADSEDNIRPYFLVSHLKVLEEYVEKKKNVYGYLHWALTDN
YEWAQGFKMRFGLTDVDLETKERKPRESSEVFKIIASEKTVPEELVEKYP
KP
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 chain7f1n Chain A Residue 601 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7f1n Structural and Catalytic Characterization of TsBGL, a beta-Glucosidase From Thermofilum sp. ex4484_79.
Resolution2.14 Å
Binding residue
(original residue number in PDB)		G199 V202 D203 D258 V260 A269
Binding residue
(residue number reindexed from 1)		G199 V202 D203 D258 V260 A269
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
GO:0008422 beta-glucosidase activity
GO:0016798 hydrolase activity, acting on glycosyl bonds
GO:0046872 metal ion binding
Biological Process
GO:0005975 carbohydrate metabolic process

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:7f1n, PDBe:7f1n, PDBj:7f1n
PDBsum7f1n
PubMed34659150
UniProtA0A256XQM7

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