Structure of PDB 5e1z Chain B Binding Site BS01

Receptor Information
>5e1z Chain B (length=169) Species: 1193806 (Dehalococcoides mccartyi BTF08) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LEVLFQGPNEFETLELEHLLWVNITQVKHSIERAWTRELKSLNLSTEKFA
ILHELMCLGGESTPHTLARRIVFEPHSVSAIVSRMEKDGLIIKTKDLDKK
HMVRIKLSEKAIDTFYQALEISNRVYKQMMASITREEKVELSKTLTKLRN
HTLPLTHKHTKTLTPFKYI
Ligand information
Ligand ID5JC
InChIInChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
InChIKeyHFZWRUODUSTPEG-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Oc1ccc(Cl)cc1Cl
ACDLabs 12.01Clc1c(ccc(c1)Cl)O
OpenEye OEToolkits 1.7.6c1cc(c(cc1Cl)Cl)O
FormulaC6 H4 Cl2 O
Name2,4-dichlorophenol
ChEMBLCHEMBL1143
DrugBank
ZINCZINC000000388057
PDB chain5e1z Chain B Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5e1z Crystal structures of RdhRCbdbA1625 provide insight into sensing of chloroaromatic compounds by MarR-type regulators
Resolution1.66 Å
Binding residue
(original residue number in PDB)		F42 A43 H46 E47
Binding residue
(residue number reindexed from 1)		F49 A50 H53 E54
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003700 DNA-binding transcription factor activity
Biological Process
GO:0006355 regulation of DNA-templated transcription

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Molecular Function
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Biological Process
External links
PDB RCSB:5e1z, PDBe:5e1z, PDBj:5e1z
PDBsum5e1z
PubMed
UniProtA0A1I9GEQ7

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