Structure of PDB 8pu1 Chain B Binding Site BS01

Receptor Information
>8pu1 Chain B (length=191) Species: 1547 (Thomasclavelia ramosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AMYILDKIGLNIEILESLSYESKLGMSFKRTLSHFNKEEVLKEIELINNW
YFSLEIIDDLPLDSRIKSVSSAKMKFERYYPNATYNRVFNDILGFRVICK
SYDEVLELEKEDKIRVVDMSRGKSNDDGFRGIHVYYQRDNHHYPIEIQFN
TYYDRQLNDWLHDKFDSSCGQLLRKYYENGKIKSAEELEEV
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 chain8pu1 Chain B Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8pu1 Structure of the toxin/antitoxin complex FaRel/ATfaRel2 with APCPP
Resolution1.702 Å
Binding residue
(original residue number in PDB)		K66 D90
Binding residue
(residue number reindexed from 1)		K67 D91
Annotation score4
Gene Ontology
Biological Process
GO:0015970 guanosine tetraphosphate biosynthetic process

View graph for
Biological Process
External links
PDB RCSB:8pu1, PDBe:8pu1, PDBj:8pu1
PDBsum8pu1
PubMed
UniProtA0A3E3DY42

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