Structure of PDB 6rme Chain E Binding Site BS02

Receptor Information

>6rme Chain E (length=376) Species: 36329 (Plasmodium falciparum 3D7) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

QWNSRYSYNQLKNKDSLIMFLVEIFRSLFVSNCIDKNIDNVLLSIEEMFI
DHYYNPQHSRLKYLIDDVGIFFTKLPITKAFHTYNKKYRITKRLYAPPTF
NEVRHILNLAQILSLEEGLDLLTFDANETLYPDGHDFNDEVLASYISCLL
KKMNIAIVTAASYNNDAEKYQKRLENLLKYFSKHNIKDGSYKNFYVMGGE
SNYLFKCNEEATLYSVPENEWRHYKKFVDYDTVQEILNISEKCLEKVIKD
FGLCAQIQRKEKSIGLVPNKINYMIKYEVLEEAVIRIKKEIIKNKITAPY
CAFNGGQDLWVDVGNKAEGLLILQKLLKIQKKKCCHIGDQFLHSGNDFPT
RFCSLTLWVSNPQETKACLKSIMHLN

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

6rme Chain E Residue 502 [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	6rme Structure and catalytic regulation of Plasmodium falciparum IMP specific nucleotidase.
Resolution	3.4 Å
Binding residue (original residue number in PDB)	D170 N172 D394
Binding residue (residue number reindexed from 1)	D125 N127 D339
Annotation score	1

Enzymatic activity

Enzyme Commision number

3.1.3.99: IMP-specific 5'-nucleotidase.

Gene Ontology

	Molecular Function
GO:0000287	magnesium ion binding
GO:0050483	IMP 5'-nucleotidase activity

	Biological Process
GO:0006190	inosine salvage
GO:0009117	nucleotide metabolic process

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Molecular Function

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Biological Process

External links

PDB	RCSB:6rme, PDBe:6rme, PDBj:6rme
PDBsum	6rme
PubMed	32591529
UniProt	A0A144A134\|ISN1_PLAF7 IMP-specific 5'-nucleotidase 1 (Gene Name=ISN1)

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