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Receptor Information

>8epz Chain B (length=568) Species: 627131 (Paralcaligenes ureilyticus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

VRRSQAWFGRLDRDGFIYRSWMKNRGIPHDQFDGRPVIGICNTFSELTPC
NSHFRTLAEQVKIGVWESGGFPLEFPVMSLGETMLRPTAMLFRNLASMDV
EESIRGNPLDGVVLLMGCDKTTPSLMMGAASCDLPTIGVSGGPMLSGKFR
GRELGSGTDVWKMSEEVRAGQMSQEEFFEAESCMHRSHGHCMTMGTASTM
ASMVEALGMSLPGNAAIPAVDARRNLLARASGRRIVQMVKDDLVMSKILT
RQAFENAIRVNAAIGGSTNAVIHLLAIAGRIGVDLTLADWDALGHKLPCL
VDLQPSGTHLMEDFYYAGGVPAVIRELGDVIARDALTVNGQTLWDNCKDA
PNWNREVIHAFNEPFKTEAGIAVLRGNLCPDGAVIKPSAATPALLKHKGR
AVVFENSEHMHERMDDENLDVDENCVLVLKNCGPRGYPGMAEAGNMPLPP
KILRKGITDMVRVSDARMSGTAYGTVVLHVAPEAAAGGPLALVQDGDIIE
LDVAARKLHLHVSDEELARRREAWQAPPAPMARGWVKLYVEHVQQANLGA
DLDFLRGKSGAGIPKDNH

Ligand ID

InChI

InChI=1S/Mn/q+2

InChIKey

WAEMQWOKJMHJLA-UHFFFAOYSA-N

SMILES

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

Formula

Name

MANGANESE (II) ION

PDB chain

8epz Chain B Residue 703 [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	8epz Crystal structure of Fe-S cluster-dependent dehydratase from Paralcaligenes ureilyticus in complex with Mg
Resolution	2.6 Å
Binding residue (original residue number in PDB)	E89 D126 K127 T203 E449
Binding residue (residue number reindexed from 1)	E82 D119 K120 T196 E442
Annotation score	4

Enzyme Commision number

	Molecular Function
GO:0016829	lyase activity
GO:0016836	hydro-lyase activity
GO:0046872	metal ion binding
GO:0051537	2 iron, 2 sulfur cluster binding

PDB	RCSB:8epz, PDBe:8epz, PDBj:8epz
PDBsum	8epz
PubMed
UniProt	A0A4R3LQ44

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Structure of PDB 8epz Chain B Binding Site BS02