Structure of PDB 5zr6 Chain A Binding Site BS03

Receptor Information
>5zr6 Chain A (length=214) Species: 1773 (Mycobacterium tuberculosis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VAQDYLKVIWTAQEWSQDKVSTKMLAERIGVSASTASESIRKLAEQGLVD
HGAVTLTDSGRRAALAMVRRHRLLETFLVNELGYRWDEVHDEAEVLEHAV
SDRLMARIDAKLGFPQRDPHGDPIPGADGQVPTPPARQLWACRDGDTGTV
ARISDADPQMLRYFASIGISLDSRLRVLARREFAGMISVAIDSADGATVD
LGSPAAQAIWVVSL
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain5zr6 Chain A Residue 303 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5zr6 Crystal structures of manganese-dependent transcriptional repressor MntR (Rv2788) from Mycobacterium tuberculosis in apo and manganese bound forms.
Resolution3.0 Å
Binding residue
(original residue number in PDB)		D16 E109 E112 H113
Binding residue
(residue number reindexed from 1)		D4 E94 E97 H98
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003677 DNA binding
GO:0003700 DNA-binding transcription factor activity
GO:0005515 protein binding
GO:0043565 sequence-specific DNA binding
GO:0046872 metal ion binding
GO:0046914 transition metal ion binding
GO:0046983 protein dimerization activity
Biological Process
GO:0006355 regulation of DNA-templated transcription
GO:0045892 negative regulation of DNA-templated transcription
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5zr6, PDBe:5zr6, PDBj:5zr6
PDBsum5zr6
PubMed29730293
UniProtI6Y1Q2

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