Structure of PDB 8sjx Chain A Binding Site BS02

Receptor Information
>8sjx Chain A (length=220) Species: 9940 (Ovis aries) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SASFWRAIFAEFFATLFYVFFGLGASLRWAPGPLHVLQVALAFGLALATL
VQAVGHISGAHVNPAVTFAFLVGSQMSLLRAICYVVAQLLGAVAGAAVLY
SVTPPAVRGNLALNTLHPGVSVGQATIVEIFLTLQFVLCIFATYDERRNG
RLGSVALAVGFSLTLGHLFGMYYTGAGMNPARSFAPAILTRNFTNHWVYW
VGPVIGAGLGSLLYDFLLFP
Ligand information
Ligand IDHWP
InChIInChI=1S/C39H79N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-38(42)37(36-47-48(44,45)46-35-34-41(3,4)5)40-39(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h30,32,37-38,42H,6-29,31,33-36H2,1-5H3,(H-,40,43,44,45)/b32-30+/t37-,38+/m0/s1
InChIKeyRWKUXQNLWDTSLO-GWQJGLRPSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7CCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)[C@@H](/C=C/CCCCCCCCCCCCC)O
CACTVS 3.385CCCCCCCCCCCCCCCC(=O)N[CH](CO[P]([O-])(=O)OCC[N+](C)(C)C)[CH](O)C=CCCCCCCCCCCCCC
CACTVS 3.385CCCCCCCCCCCCCCCC(=O)N[C@@H](CO[P]([O-])(=O)OCC[N+](C)(C)C)[C@H](O)\C=C\CCCCCCCCCCCCC
OpenEye OEToolkits 2.0.7CCCCCCCCCCCCCCCC(=O)NC(COP(=O)([O-])OCC[N+](C)(C)C)C(C=CCCCCCCCCCCCCC)O
FormulaC39 H79 N2 O6 P
Name[(E,2S,3R)-2-(hexadecanoylamino)-3-oxidanyl-octadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate;
N-Palmitoylsphingomyelin
ChEMBLCHEMBL4526394
DrugBank
ZINC
PDB chain8sjx Chain A Residue 303 [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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PDB8sjx Structure of aquaporin-0 arrays in sphingomyelin/cholesterol membranes and implications for lipid
Resolution2.5 Å
Binding residue
(original residue number in PDB)		V91 L94 L95 Y105 L194 R196
Binding residue
(residue number reindexed from 1)		V86 L89 L90 Y100 L189 R191
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005212 structural constituent of eye lens
GO:0005515 protein binding
GO:0005516 calmodulin binding
GO:0015250 water channel activity
GO:0015267 channel activity
Biological Process
GO:0002088 lens development in camera-type eye
GO:0006833 water transport
GO:0007601 visual perception
GO:0045785 positive regulation of cell adhesion
GO:0051289 protein homotetramerization
GO:0055085 transmembrane transport
GO:1990349 gap junction-mediated intercellular transport
Cellular Component
GO:0005783 endoplasmic reticulum
GO:0005886 plasma membrane
GO:0005921 gap junction
GO:0016020 membrane
GO:0016324 apical plasma membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:8sjx, PDBe:8sjx, PDBj:8sjx
PDBsum8sjx
PubMed
UniProtQ6J8I9|MIP_SHEEP Lens fiber major intrinsic protein (Gene Name=MIP)

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