Structure of PDB 2jfs Chain A Binding Site BS02

Receptor Information
>2jfs Chain A (length=232) Species: 246196 (Mycolicibacterium smegmatis MC2 155) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ASVLSAATATDQGPVRENNQDACLADGILYAVADGFGARGHHASATALKT
LSAGFAAAPDRDGLLEAVQQANLRVFELLGDEPTVSGTTLTAVAVFEPGQ
GGPLVVNIGDSPLYRIRDGHMEQLTDDHSVAGELVRMGEITRHEARWHPQ
RHLLTRALGIGPHIGPDVFGIDCGPGDRLLISSDGLFAAADEALIVDAAT
SPDPQVAVRRLVEVANDAGGSDNTTVVVIDLG
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 chain2jfs Chain A Residue 1235 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2jfs Insights Into the Mechanism of Ppm Ser/Thr Phosphatases from the Atomic Resolution Structures of a Mycobacterial Enzyme
Resolution1.45 Å
Binding residue
(original residue number in PDB)		D35 D185 D223
Binding residue
(residue number reindexed from 1)		D34 D184 D222
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.3.16: protein-serine/threonine phosphatase.
Gene Ontology
Molecular Function
GO:0004722 protein serine/threonine phosphatase activity
GO:0046872 metal ion binding
Biological Process
GO:0006470 protein dephosphorylation

View graph for
Molecular Function
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Biological Process
External links
PDB RCSB:2jfs, PDBe:2jfs, PDBj:2jfs
PDBsum2jfs
PubMed17637345
UniProtA0QTQ6

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