Structure of PDB 7e4n Chain A Binding Site BS01

Receptor Information
>7e4n Chain A (length=290) Species: 168694 (Salinispora) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NAMVPTHHAGNGFAVASEQGRICALAARGQRDLRQCVRAYPSLFPNPPVD
DTMLSALALSTAFIAPWCSAEQLRVANRASLWVTAEDWQVDRVATSDDAV
RSIVSACQAVADGAAPDVDCALGQLLAEIRDELATGAGFTEWQPVWREEV
RRMLTADIREWEWRHSARPPSFAEYLDNADNYGASFVNVSHWIVTGDAQT
RSHLPELIAASREVQRILRLSNDLASYERDIRSGDLNALLLVDREEVSRQ
LRDRIRACQDHLHALEVTCPREALYLAREAGFTTGFYHGA
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 chain7e4n Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7e4n Functional characterization and structural bases of two class I diterpene synthases in pimarane-type diterpene biosynthesis
Resolution1.94 Å
Binding residue
(original residue number in PDB)
D88 N182
Binding residue
(residue number reindexed from 1)
D87 N181
Annotation score4
External links