Structure of PDB 8vsw Chain A Binding Site BS01

Receptor Information
>8vsw Chain A (length=67) Species: 562 (Escherichia coli) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GSRVKALEEKVKALEEKVKALGGGGRIEELKKKCEELKKKIEELGGGGEV
KKVEEEVKKLEEEIKKL
Ligand information
Ligand IDHTU
InChIInChI=1S/C6H6OS/c7-5-1-3-6(8)4-2-5/h1-4,7-8H
InChIKeyBXAVKNRWVKUTLY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6c1cc(ccc1O)S
ACDLabs 12.01
CACTVS 3.370		Oc1ccc(S)cc1
FormulaC6 H6 O S
Name4-sulfanylphenol
ChEMBL
DrugBank
ZINC
PDB chain8vsw 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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PDB8vsw Switching the proton-coupled electron transfer mechanism for non-canonical tyrosine residues in a de novo protein.
ResolutionN/A
Binding residue
(original residue number in PDB)		E15 V18 K19 K31 C34 K38
Binding residue
(residue number reindexed from 1)		E15 V18 K19 K31 C34 K38
Annotation score1
External links