Structure of PDB 3zm7 Chain F Binding Site BS02

Receptor Information
>3zm7 Chain F (length=357) Species: 1773 (Mycobacterium tuberculosis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SITILEGLEAVRKRPGMYIGSTGERGLHHLIWEVVDNAVDEAMAGYATTV
NVVLLEDGGVEVADDGRGIPVATHASGIPTVDVVMTQLHGVGVSVVNALS
TRLEVEIKRDGYEWSQVYEKSEPLGLKQGAPTKKTGSTVRFWADPAVFET
TEYDFETVARRLQEMAFLNKGLTINLTDERVKVKSRTFHYPGGLVDFVKH
INRTKNAIHSSIVDFSGKGTGHEVEIAMQWNAGYSESVHTFANTINTHEG
GTHEEGFRSALTSVVNKYAKDRKLLKDPNLTGDDIREGLAAVISVKVSEP
QFETKTKLGNTEVKSFVQKVCNEQLTHWFEANPTDAKVVVNKAVSSAQAR
IAARKAR
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 chain3zm7 Chain F Residue 526 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3zm7 Mycobacterium Tuberculosis DNA Gyrase ATPase Domain Structures Suggest a Dissociative Mechanism that Explains How ATP Hydrolysis is Coupled to Domain Motion.
Resolution3.3 Å
Binding residue
(original residue number in PDB)		N52 G124
Binding residue
(residue number reindexed from 1)		N37 G92
Annotation score4
Enzymatic activity
Enzyme Commision number 5.6.2.2: DNA topoisomerase (ATP-hydrolyzing).
Gene Ontology
Molecular Function
GO:0003677 DNA binding
GO:0003918 DNA topoisomerase type II (double strand cut, ATP-hydrolyzing) activity
GO:0005524 ATP binding
Biological Process
GO:0006265 DNA topological change

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Molecular Function
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Biological Process
External links
PDB RCSB:3zm7, PDBe:3zm7, PDBj:3zm7
PDBsum3zm7
PubMed24015710
UniProtP9WG45|GYRB_MYCTU DNA gyrase subunit B (Gene Name=gyrB)

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