Structure of PDB 5fno Chain B Binding Site BS01

Receptor Information
>5fno Chain B (length=568) Species: 318829 (Pyricularia oryzae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VVYTLPCEDGNSTARTAEIRLKQATLLYGPSLLGNASYFPGGPLGDAISL
RDQTVWEGAAVVQSLRAFTDAAKVAANIKQNGGLNSLDDFKVLYQDGWKG
SVPQGIARGQSENYTSDLLFSMERLSVNPYILKRLHPTEDALPFQVDRAT
VKQLTKTSLKALHAAGRLFVADHSYQRNYTRLANRYSAACTALFYLDPRS
NQFLPLAIKTNVGADLTYTPLDTDNNNWLLAKIMFNNNDLFHGQIFHVAY
PHAIAEIVHLAALRTMSARHPVLALMERLMYQAYAVRPLGERVLFNKGGL
FEQNFAYPQDMVYKFVGDSYPTTGRWRAGYLDTDVRARGLVDADYGPELP
HFPFYEDGSRLVEVIRRFVRSFVDATYHESDEMVAKDAELQAWVAEANGP
AGVEDFEPGPLDTRERLVEVLTHMAWLTGCAHHVLNQGEPVTASGVLPMH
PTALYAPVPTSKANTTADLLGYLPSAQKSVDQVTLLARFNRPDVVPTNQT
LRYMFAAPQLLLGNGEAYRRANQRFVRAMGRISDEVKARRFDDRGLSQGM
PFIWQALDPGNIPFYLSV
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 chain5fno Chain B Residue 606 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5fno Crystal Structure of Manganese Lipoxygenase of the Rice Blast Fungus Magnaporthe Oryzae
Resolution2.038 Å
Binding residue
(original residue number in PDB)		H284 H289 H469 N473 V605
Binding residue
(residue number reindexed from 1)		H247 H252 H432 N436 V568
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) H284 H289 H469 N473
Catalytic site (residue number reindexed from 1) H247 H252 H432 N436
Enzyme Commision number 1.13.11.-
1.13.11.45: linoleate 11-lipoxygenase.
1.13.11.58: linoleate 9S-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
GO:0050584 linoleate 11-lipoxygenase activity
GO:0051213 dioxygenase activity
GO:1990136 linoleate 9S-lipoxygenase activity
Biological Process
GO:0034440 lipid oxidation
GO:0043651 linoleic acid metabolic process
Cellular Component
GO:0005576 extracellular region

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5fno, PDBe:5fno, PDBj:5fno
PDBsum5fno
PubMed26783260
UniProtG4NAP4|MNLOX_PYRO7 Manganese lipoxygenase (Gene Name=MGG_08499)

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