Structure of PDB 7erp Chain B Binding Site BS01

Receptor Information
>7erp Chain B (length=199) Species: 28141 (Cronobacter sakazakii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AIRVYASSTIGNYILPEIIARYRRDFPDLPLEMSVGNSLDVVQAVCDFRV
DIGLIEGPCHMAEIVAQPWLEDELVVFASPASPLLEGEVTLERLAAMPWI
LREKGSGTREIVDYLLLSHLPQFRLSMELGNSEAIKHAVRHGLGVSCLSR
RVIAEQLETGSLVEVKVPLPPLVRTLYRIHHRQKHLSSALARFLRYCEL
Ligand information
Ligand IDSO3
InChIInChI=1S/H2O3S/c1-4(2)3/h(H2,1,2,3)/p-2
InChIKeyLSNNMFCWUKXFEE-UHFFFAOYSA-L
SMILES
SoftwareSMILES
CACTVS 3.341[O-][S]([O-])=O
OpenEye OEToolkits 1.5.0[O-]S(=O)[O-]
ACDLabs 10.04[O-]S([O-])=O
FormulaO3 S
NameSULFITE ION
ChEMBL
DrugBank
ZINC
PDB chain7erp Chain B Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7erp Crystal structures of YeiE from Cronobacter sakazakii and the role of sulfite tolerance in gram-negative bacteria.
Resolution2.03 Å
Binding residue
(original residue number in PDB)		S97 N126 S127 E145 R191 S195 T197
Binding residue
(residue number reindexed from 1)		S8 N37 S38 E56 R102 S106 T108
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links