Structure of PDB 7vor Chain 6 Binding Site BS05
Receptor Information
>7vor Chain 6 (length=48) Species:
272943
(Cereibacter sphaeroides 2.4.1) [
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MSKFYKIWMIFDPRRVFVAQGVFLFLLAVMIHLILLSTPSYNWLEISA
Ligand information
Ligand ID
SPO
InChI
InChI=1S/C41H60O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-16,18-22,24-28,30-32H,14,17,23,29,33H2,1-11H3/b13-12+,24-15+,25-16+,30-18+,32-19+,35-21+,36-22-,37-26+,38-27+,39-28+,40-31+
InChIKey
FJOCMTHZSURUFA-KXCOHNEYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)OC)C)C)C)C
CACTVS 3.341
COC(C)(C)C\C=C\C(C)=C\C=C\C(C)=C\C=C\C(C)=C/C=C/C=C(C)/C=C/C=C(\C)CC\C=C(/C)CCC=C(C)C
CACTVS 3.341
COC(C)(C)CC=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)CCC=C(C)CCC=C(C)C
ACDLabs 10.04
O(C(C\C=C\C(=C\C=C\C(=C\C=C\C(=C/C=C/C=C(/C=C/C=C(\C)CC\C=C(/C)CC\C=C(/C)C)C)C)C)C)(C)C)C
OpenEye OEToolkits 1.5.0
CC(=CCCC(=CCC/C(=C/C=CC(=CC=C\C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=CCC(C)(C)OC)C)/C)C)C
Formula
C41 H60 O
Name
SPHEROIDENE
ChEMBL
DrugBank
ZINC
ZINC000064446704
PDB chain
7vor Chain x Residue 101 [
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Receptor-Ligand Complex Structure
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PDB
7vor
Structural basis for the assembly and quinone transport mechanisms of the dimeric photosynthetic RC-LH1 supercomplex.
Resolution
2.74 Å
Binding residue
(original residue number in PDB)
Q20 L24 L27 I34
Binding residue
(residue number reindexed from 1)
Q20 L24 L27 I34
Annotation score
4
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
GO:0046872
metal ion binding
Biological Process
GO:0019684
photosynthesis, light reaction
Cellular Component
GO:0005886
plasma membrane
GO:0016020
membrane
GO:0019866
organelle inner membrane
GO:0030076
light-harvesting complex
GO:0030077
plasma membrane light-harvesting complex
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:7vor
,
PDBe:7vor
,
PDBj:7vor
PDBsum
7vor
PubMed
35418573
UniProt
Q3J1A4
|LHA1_CERS4 Light-harvesting protein B-875 alpha chain (Gene Name=pufA)
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