Structure of PDB 3ke6 Chain B Binding Site BS01

Receptor Information
>3ke6 Chain B (length=348) Species: 1773 (Mycobacterium tuberculosis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VSVPVVPGADIAAEYLVAAEDTAAGGDWFDALALGDRLVLVVGDVVGHGV
EAAAVMSQLRTALRMQISAGYTVVEALEAVDRFHKQVPGSKSATMCVGSL
DFTSGEFQYCTAGHPPPLLVTADASARYVEPTGAGPLGSGTGFPVRSEVL
NIGDAILFYTDGLIERPGRPLEASTAEFADLAASIASGARPIDRLCSDTL
ELLLRSTGYNDDVTLLAMQRRAPTPPLHITLDATINAARTVRAQLREWLA
EIGADHSDIADIVHAISEFVENAVEHGYATDVSKGIVVAAALAGDGNVRA
SVIDRGQWGLAMAEALVSEARIMHGAGGTTATLTHRLSRPARFVTDTM
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 chain3ke6 Chain B Residue 3 [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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PDB3ke6 The crystal structure of the RsbU and RsbW domains of Rv1364c from Mycobacterium tuberculosis
Resolution2.6 Å
Binding residue
(original residue number in PDB)		D211 V212
Binding residue
(residue number reindexed from 1)		D44 V45
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.11.1: non-specific serine/threonine protein kinase.
3.1.3.16: protein-serine/threonine phosphatase.
External links
PDB RCSB:3ke6, PDBe:3ke6, PDBj:3ke6
PDBsum3ke6
PubMed
UniProtP9WLZ7|MTDRP_MYCTU Multidomain regulatory protein Rv1364c (Gene Name=Rv1364c)

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