Structure of PDB 5hpi Chain C Binding Site BS01

Receptor Information
>5hpi Chain C (length=174) Species: 62977 (Acinetobacter baylyi ADP1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HLPKVAQSFLNLLCAQTSLTFSIVVLDEHEVVPVARSYLPQQDNRVSPYG
MHLGNRLPAHATSTGKVLLSVLDREVQIEWIEKYGLKRLTPYTITDEHTF
LETLDAVRQSDYCLSTEEHELGVIAIAVPVLNAQGLTIAALNCMSQTNRV
QPQYLIDQVLPLLRNTANELRNLV
Ligand information
Ligand ID3HB
InChIInChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10)
InChIKeyIJFXRHURBJZNAO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01O=C(O)c1cc(O)ccc1
OpenEye OEToolkits 1.7.2c1cc(cc(c1)O)C(=O)O
CACTVS 3.370OC(=O)c1cccc(O)c1
FormulaC7 H6 O3
Name3-HYDROXYBENZOIC ACID
ChEMBLCHEMBL65369
DrugBank
ZINCZINC000000388754
PDB chain5hpi Chain C 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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PDB5hpi A microbial sensor for organophosphate hydrolysis exploiting an engineered specificity switch in a transcription factor.
Resolution2.963 Å
Binding residue
(original residue number in PDB)		T159 S160 A222 M241
Binding residue
(residue number reindexed from 1)		T62 S63 A125 M144
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5hpi, PDBe:5hpi, PDBj:5hpi
PDBsum5hpi
PubMed27536006
UniProtQ43992|POBR_ACIAD p-hydroxybenzoate hydroxylase transcriptional activator (Gene Name=pobR)

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