Structure of PDB 5h9l Chain A Binding Site BS01

Receptor Information
>5h9l Chain A (length=154) Species: 13249 (Rhodnius prolixus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VTSIPTGCNALSGKIMSGFDANRFFTGDWYLTHSRDSEVPVRCEKYQTGS
NLQLNFNGKNGDVKCSGSTVSGNQGFYSFQCTTTSGGSFTSYMAVVETDY
ANYALLYRCGLYGSTTPKDNFLLFNRQSSGEIPAGLSTKLNQLELTSLNK
LGCS
Ligand information
Ligand IDEAH
InChIInChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-14,19,21H,2-5,8,15-18H2,1H3,(H,22,23)/b7-6-,10-9-,12-11+,14-13+/t19-/m1/s1
InChIKeyDVGDBDLZYCUGNU-LBIUVHPXSA-N
SMILES
SoftwareSMILES
CACTVS 3.341CCCCC\C=C/C/C=C\C=C\C=C\C[C@@H](O)CCCC(O)=O
ACDLabs 10.04O=C(O)CCCC(O)C/C=C/C=C/C=C\C\C=C/CCCCC
CACTVS 3.341CCCCCC=CCC=CC=CC=CC[CH](O)CCCC(O)=O
OpenEye OEToolkits 1.5.0CCCCCC=CCC=CC=CC=CCC(CCCC(=O)O)O
OpenEye OEToolkits 1.5.0CCCCC\C=C/C\C=C/C=C/C=CC[C@H](CCCC(=O)O)O
FormulaC20 H32 O3
Name(5S,7E,9E,11Z,14Z)-5-hydroxyicosa-7,9,11,14-tetraenoic acid
ChEMBL
DrugBank
ZINCZINC000064474589
PDB chain5h9l Chain A Residue 201 [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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PDB5h9l Structure and Ligand-Binding Mechanism of a Cysteinyl Leukotriene-Binding Protein from a Blood-Feeding Disease Vector.
Resolution1.37 Å
Binding residue
(original residue number in PDB)
F58 F91 S93 M95 R110 N122
Binding residue
(residue number reindexed from 1)
F56 F89 S91 M93 R108 N120
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0030682 symbiont-mediated perturbation of host defenses
Cellular Component
GO:0005576 extracellular region

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Biological Process

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Cellular Component
External links
PDB RCSB:5h9l, PDBe:5h9l, PDBj:5h9l
PDBsum5h9l
PubMed27124118
UniProtQ7YT09

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