Structure of PDB 5fx8 Chain A Binding Site BS01

Receptor Information

>5fx8 Chain A (length=563) Species: 36778 (Gaeumannomyces avenae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

QYTLPNNDPNQGARNASIARKRELFLYGPSTLGQTTFYPTGELGNNISAR
DVLLWRQDAANQTATAYREANETFADITSRGGFKTLDDFALLYNGHWKES
VPEGISKGMLSNCTSDLLFSMERLSSNPYVLKRLHPTKDKLPFSVESKVV
KKLTATTLEALHKGGRLFLVDHSYQKKYTPQPGRYAAACQGLFYLDARSN
QFLPLAIKTNVGVDLTYTPLDDKDDWLLAKIMFNNNDLFYSQMYHVLFHT
IPEIVHEAAFRTLSDRHPVMGVLNRLMYQAYAIRPVGGAVLFNPGGFWDQ
NFGLPASAAIDFPGSVYAQGGGGFQAGYLEKDLRSRGLIGEDSGPRLPHF
PFYEDAHRLIGAIRRFMQAFVDSTYGADDDGALLRDYELQNWIAEANGPA
QVRDFPAAPLRRRAQLVDVLTHVAWITGGAHHVMNQGSPVKFSGVLPLHP
AALYAPIPTAKGALLAWLPNERQAVEQVSLLARFNRAQVGDRKQTVRDAF
AAPDLLAGNGPGYAAANARFVEDTGRISREIAGRGFDGKGLSQGMPFVWT
ALNPAVNPFFLSV

Ligand information

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

5fx8 Chain A Residue 1000 [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	5fx8 Crystal Structure of Linoleate 13R-Manganese Lipoxygenase and an Adhesion Protein
Resolution	2.6 Å
Binding residue (original residue number in PDB)	H290 H294 H478 N482 V618
Binding residue (residue number reindexed from 1)	H245 H249 H431 N435 V563
Annotation score	1

Enzymatic activity

Enzyme Commision number

1.13.11.-
1.13.11.45: linoleate 11-lipoxygenase.

Gene Ontology

	Molecular Function
GO:0016702	oxidoreductase activity, acting on single donors with incorporation of molecular oxygen, incorporation of two atoms of oxygen
GO:0046872	metal ion binding

	Biological Process
GO:0034440	lipid oxidation

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Molecular Function

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Biological Process

External links

PDB	RCSB:5fx8, PDBe:5fx8, PDBj:5fx8
PDBsum	5fx8
PubMed	27313058
UniProt	Q8X151\|MNLOX_GAEAV Manganese lipoxygenase

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