Structure of PDB 6w26 Chain I Binding Site BS03

Receptor Information
>6w26 Chain I (length=303) Species: 229533 (Fusarium graminearum PH-1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SETSDLVDISRFDTHGLGANYKLRRHKFEHLADTGCHKARSDWVKYIGPL
TEFGGCNHINGNFSAVVLPLCRPDRLELIAYVLEFAFLHDSVLESENTSP
ESEVQAEAGLRLLYERCISRLLQTDEVCAKKIAKTWKDAINTTTKDKNVD
FQSIEDYLEFRMIDTGAPFVEALMLFGLGMSLSPQEDDALGHVIRPCFAA
LALTNDYFSFDREIEEVDTSTLINSVAIVMRIQSLDIPTAKTIINETIQK
YEREFLRRIDEYKQHKPISNKIEQYMEAMTYQISGNLVWSLNCPRYNPDY
RYG
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 chain6w26 Chain I Residue 404 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6w26 Discovery of the cryptic function of terpene cyclases as aromatic prenyltransferases.
Resolution2.15 Å
Binding residue
(original residue number in PDB)		N209 S213 E217
Binding residue
(residue number reindexed from 1)		N205 S209 E213
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) F91 A143 A171 W294
Catalytic site (residue number reindexed from 1) F87 A139 A167 W289
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:6w26, PDBe:6w26, PDBj:6w26
PDBsum6w26
PubMed32769971
UniProtI1RDR8

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