Structure of PDB 5d1r Chain A Binding Site BS01

Receptor Information
>5d1r Chain A (length=227) Species: 83331 (Mycobacterium tuberculosis CDC1551) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AREQIEAKIVELGRRQLLDHGAAGLSLRAIARNLGMVSSAVYRYVSSRDE
LLTLLLVDAYSDLADTVDRARDDTVADSWSDDVIAIARAVRGWAVTNPAR
WALLYGSPVPGYHAPPDRTAGVATRVVGAFFDAIAAGIATGDIRLTDDVA
PQPMSSDFEKIRQEFGFPGDDRVVTKCFLLWAGVVGAISLEVFGQYGADM
LTDPGVVFDAQTRLLVAVLAEHHHHHH
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain5d1r Chain A Residue 304 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5d1r Structural Basis for the Regulation of the MmpL Transporters of Mycobacterium tuberculosis.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		N109 P110 A111 R112
Binding residue
(residue number reindexed from 1)		N97 P98 A99 R100
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000976 transcription cis-regulatory region binding
GO:0003677 DNA binding
GO:0003700 DNA-binding transcription factor activity
Biological Process
GO:0006355 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:5d1r, PDBe:5d1r, PDBj:5d1r
PDBsum5d1r
PubMed26396194
UniProtP9WMC9|Y1816_MYCTU HTH-type transcriptional regulator Rv1816 (Gene Name=Rv1816)

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