Structure of PDB 5jr5 Chain D Binding Site BS01

Receptor Information
>5jr5 Chain D (length=52) Species: 2280 (Staphylothermus marinus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GSIINETADDIVYRLTVIIDDRYESLKNLITLRADRLEMIINDNVSTILA
SI
Ligand information
Ligand IDPS9
InChIInChI=1S/S8/c1-2-4-6-8-7-5-3-1
InChIKeyJLQNHALFVCURHW-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0
S1SSSSSSS1
FormulaS8
Nameoctathiocane
ChEMBLCHEMBL1235452
DrugBankDB09353
ZINC
PDB chain5jr5 Chain A Residue 101 [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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PDB5jr5 Archaea S-layer nanotube from a "black smoker" in complex with cyclo-octasulfur (S8 ) rings.
Resolution1.9 Å
Binding residue
(original residue number in PDB)
R22 Y23
Binding residue
(residue number reindexed from 1)
R22 Y23
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links