Structure of PDB 8sfc Chain D Binding Site BS01

Receptor Information

>8sfc Chain D (length=292) Species: 273057 (Saccharolobus solfataricus P2) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

RIPLVGKDSIESKDIGFTLIHEHLRGFSEAVRQQWPHLYNEDEEFRNAVN
EVKRAMQFGVKTIVDPTVMGCGRDIRFMEKVVKATGINLVAGTGIIIFID
LPFYFLNRSIDEIADLFIHDIKEGIQGTLNKAGFVKIAADEPGITKDVEK
VIKAAAIANKETKVPIITHSNAHNNTGLEQQRILTEEGVDPGKILIGHLG
DTDNIDYIKKIADKGSFIGLDRYGVDKRNETTLRLIKDGYSDKIMISHDY
CCTIDWSITLIFEDTIPFLKRNGVNEEVIATIFKENPKKFFS

Ligand information

Ligand ID

InChI

InChI=1S/Fe/q+3

InChIKey

VTLYFUHAOXGGBS-UHFFFAOYSA-N

SMILES

Software	SMILES
ACDLabs 10.04 CACTVS 3.341 OpenEye OEToolkits 1.5.0	[Fe+3]

Formula

Name

FE (III) ION

PDB chain

8sfc Chain D Residue 401 [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	8sfc Changes in Active Site Loops Conformation Relates to a Transition from Lactonase to Phosphotriesterase
Resolution	1.4 Å
Binding residue (original residue number in PDB)	H22 H24 K137 D256
Binding residue (residue number reindexed from 1)	H21 H23 K136 D249
Annotation score	1

Enzymatic activity

Enzyme Commision number

3.1.8.1: aryldialkylphosphatase.

Gene Ontology

	Molecular Function
GO:0004063	aryldialkylphosphatase activity
GO:0008270	zinc ion binding
GO:0016787	hydrolase activity
GO:0016788	hydrolase activity, acting on ester bonds
GO:0046872	metal ion binding

	Biological Process
GO:0009056	catabolic process

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Molecular Function

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Biological Process

External links

PDB	RCSB:8sfc, PDBe:8sfc, PDBj:8sfc
PDBsum	8sfc
PubMed
UniProt	Q97VT7\|PHP_SACS2 Aryldialkylphosphatase (Gene Name=php)

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