Structure of PDB 8owu Chain B Binding Site BS01

Receptor Information
>8owu Chain B (length=76) Species: 1053183 (Bacillus cereus BAG3X2-1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
FQGMTKKEILEKLPEGWKYTENNGFVHVRDANDTIRMRIAPPDKVTKYDH
VHLYDENKNPLDLNGNIVDPDAHIPY
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 chain8owu Chain B Residue 101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8owu Systematic Discovery of Antibacterial and Antifungal Bacterial Toxins
Resolution2.54 Å
Binding residue
(original residue number in PDB)
H47 H49 H73
Binding residue
(residue number reindexed from 1)
H50 H52 H73
Annotation score4
External links