Structure of PDB 3t7d Chain A Binding Site BS07

Receptor Information
>3t7d Chain A (length=459) Species: 264445 (Streptomyces hygroscopicus subsp. limoneus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
FTGSEIFLASKRAAITYNVVAEQAGVLNISWIASADSEDDRRASALNPDG
VTMELHSGREILVRLIRHDPAVFRNVQNFMTANLMWAANNYGWDRWTQPS
FGSDAREGWADFGRFTRDFADAILKSSAQSADPVYLVHDYQLVGVPALLR
EQRPDAPILLFVHIPWPSADYWRILPKEIRTGILHGMLPATTIGFFADRW
CRNFLESVADLLPDARIDREAMTVEWRGHRTRLRTMPLGYSPLTLDGRNP
QLPEGIEEWADGHRLVVHSGRTDPIKNAERAVRAFVLAARGGGLEKTRML
VRMNPNRLYVPANADYVHRVETAVAEANAELGSDTVRIDNDNDVNHTIAC
FRRADLLIFNSTVDGQNLSTFEAPLVNERDADVILSETCGAAEVLGEYCR
SVNPFDLVEQAEAISAALAAGPRQRAEAAARRRDAARPWTLEAWVQAQLD
GLAADHAAR
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 chain3t7d Chain A Residue 504 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3t7d Structural basis for the substrate specificity of ValL
Resolution1.7 Å
Binding residue
(original residue number in PDB)		R125 K196 E197
Binding residue
(residue number reindexed from 1)		R106 K177 E178
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) H182 D383
Catalytic site (residue number reindexed from 1) H163 D364
Enzyme Commision number 2.5.1.135: validamine 7-phosphate valienyltransferase.
Gene Ontology
Molecular Function
GO:0003824 catalytic activity
GO:0016740 transferase activity
GO:0016758 hexosyltransferase activity
Biological Process
GO:0005992 trehalose biosynthetic process
GO:0017000 antibiotic biosynthetic process

View graph for
Molecular Function
View graph for
Biological Process
External links
PDB RCSB:3t7d, PDBe:3t7d, PDBj:3t7d
PDBsum3t7d
PubMed
UniProtQ15JG1|VLDE_STRHL Validamine 7-phosphate valienyltransferase (Gene Name=vldE)

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