Structure of PDB 1o6y Chain A Binding Site BS02

Receptor Information

>1o6y Chain A (length=260) Species: 83332 (Mycobacterium tuberculosis H37Rv) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

TPSHLSDRYELGEILGFGGMSEVHLARDLRLHRDVAVKVLRADLARDPSF
YLRFRREAQNAAALNHPAIVAVYDTGEAETPAGPLPYIVMEYVDGVTLRD
IVHTEGPMTPKRAIEVIADACQALNFSHQNGIIHRDVKPANIMISATNAV
KVMDFGIARAIAQYLSPEQARGDSVDARSDVYSLGCVLYEVLTGEPPFTG
DSPVSVAYQHVREDPIPPSARHEGLSADLDAVVLKALAKNPENRYQTAAE
MRADLVRVHN

Ligand information

Ligand ID

InChI

InChI=1S/Mg/q+2

InChIKey

JLVVSXFLKOJNIY-UHFFFAOYSA-N

SMILES

Software	SMILES
ACDLabs 10.04 OpenEye OEToolkits 1.5.0	[Mg+2]
CACTVS 3.341	[Mg++]

Formula

Name

MAGNESIUM ION

PDB chain

1o6y Chain A Residue 1280 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

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Structure summary

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PDB	1o6y Crystal Structure of the Catalytic Domain of the Pknb Serine/Threonine Kinase from Mycobacterium Tuberculosis
Resolution	2.2 Å
Binding residue (original residue number in PDB)	N143 D156
Binding residue (residue number reindexed from 1)	N141 D154
Annotation score	1

Enzymatic activity

Catalytic site (original residue number in PDB)	D138 K140 A142 N143 D156
Catalytic site (residue number reindexed from 1)	D136 K138 A140 N141 D154
Enzyme Commision number	2.7.11.1: non-specific serine/threonine protein kinase.

Gene Ontology

	Molecular Function
GO:0004672	protein kinase activity
GO:0005524	ATP binding

	Biological Process
GO:0006468	protein phosphorylation

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Molecular Function

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Biological Process

External links

PDB	RCSB:1o6y, PDBe:1o6y, PDBj:1o6y
PDBsum	1o6y
PubMed	12551895
UniProt	P9WI81\|PKNB_MYCTU Serine/threonine-protein kinase PknB (Gene Name=pknB)

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