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Structure of PDB 7p17 Chain H Binding Site BS01

Receptor Information
>7p17 Chain H (length=242) Species: 1063 (Cereibacter sphaeroides) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NFDLASLAIYSFWIFLAGLIYYLQTENMREGYPLENEDGTPAANQGPFPL
PKPKTFILPHGRGTLTVPGPESEDRPIALARTAVSEGFPHAPTGDPMKDG
VGPASWVARRDLPELDGHGHNKIKPMKAAAGFHVSAGKNPIGLPVRGCDL
EIAGKVVDIWVDIPEQMARFLEVELKDGSTRLLPMQMVKVQSNRVHVNAL
SSDLFAGIPTIKSPTEVTLLEEDKICGYVAGGLMYAAPKRKS
Ligand information
Ligand IDNKP
InChIInChI=1S/C21H41O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h9-10,20,22H,2-8,11-19H2,1H3,(H2,24,25,26)/b10-9+/t20-/m1/s1
InChIKeyWRGQSWVCFNIUNZ-SQUSKLHYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)O)O
CACTVS 3.370CCCCCCCCC=CCCCCCCCC(=O)OC[CH](O)CO[P](O)(O)=O
CACTVS 3.370CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@@H](O)CO[P](O)(O)=O
OpenEye OEToolkits 1.7.0CCCCCCCC/C=C/CCCCCCCC(=O)OC[C@H](COP(=O)(O)O)O
ACDLabs 12.01O=P(OCC(O)COC(=O)CCCCCCC/C=C/CCCCCCCC)(O)O
FormulaC21 H41 O7 P
Name(2R)-2-hydroxy-3-(phosphonooxy)propyl (9E)-octadec-9-enoate;
18:1 LPA;
oleoyl lysophosphatidic acid
ChEMBL
DrugBank
ZINCZINC000014953257
PDB chain7p17 Chain M Residue 401 [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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PDB7p17 X-Ray structure of Rhodobacter sphaeroides reaction center with M197 Phe-His substitution clarifies properties of the mutant complex
Resolution2.22 Å
Binding residue
(original residue number in PDB)		G26 Y29 Y30
Binding residue
(residue number reindexed from 1)		G18 Y21 Y22
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0042314 bacteriochlorophyll binding
GO:0045156 electron transporter, transferring electrons within the cyclic electron transport pathway of photosynthesis activity
Biological Process
GO:0015979 photosynthesis
GO:0019684 photosynthesis, light reaction
Cellular Component
GO:0016020 membrane
GO:0030077 plasma membrane light-harvesting complex
GO:0042717 plasma membrane-derived chromatophore membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7p17, PDBe:7p17, PDBj:7p17
PDBsum7p17
PubMed
UniProtP0C0Y7|RCEH_CERSP Reaction center protein H chain (Gene Name=puhA)

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