Structure of PDB 8x2j Chain C Binding Site BS05

Receptor Information
>8x2j Chain C (length=449) Species: 324602 (Chloroflexus aurantiacus J-10-fl) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EAYLLPGETYTSISAKIGDVPLTPPLKTPKGWLAGFSVAFFMLMIFFVSV
TWLFIRGVGIWGINIPVGWGMDIINFVWWIGIGHAGTLISAILLLLNQGW
RNSINRFAEAMTLFAVACAGLYPILHLGRPWLFYWLIPYPNTHGMWPQFR
SALAWDVFAISTYATVSLVFWLVGLIPDFATLRDRAKNIWVKRLYGIAAL
GWRGSARHWHRYEMASILLAGLSTPLVVSVHSIISLDFAISQVPGWQVTV
FPPYFVAGAVFAGFAMVLLLMIPVRTFYGFENYITLHHLDVMAKVMLTTG
MIVVYGYFMEVFASLYSGNEFEEYLLYNRLFGPSSWAYWGLLFCNAVAIQ
PLWFKKVRQNIPALLIISLIVSVGMWLERYVIIVISLERDFLPSSWDIYI
PTIWDWSLYIGTFGLFFTLLFLFIRVLPMINIFEMRLFLYQETEKAKQR
Ligand information
Ligand IDJM9
InChIInChI=1S/C48H92O6/c1-6-7-8-9-10-11-12-13-18-25-30-35-40-48(51)54-45(41-52-46(49)38-33-28-23-19-14-16-21-26-31-36-43(2)3)42-53-47(50)39-34-29-24-20-15-17-22-27-32-37-44(4)5/h43-45H,6-42H2,1-5H3
InChIKeyFXZBBNDITVPQLC-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.7		CCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCC(C)C
FormulaC48 H92 O6
Name1,3-bis(13-methyltetradecanoyloxy)propan-2-yl pentadecanoate
ChEMBL
DrugBank
ZINC
PDB chain8x2j Chain C Residue 504 [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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PDB8x2j Cryo-EM structure of HQNO-bound Alternative Complex III from the anoxygenic phototrophic bacterium Chloroflexus aurantiacus.
Resolution2.7 Å
Binding residue
(original residue number in PDB)		L110 M229 I232 L233 G236 L237 P240 V243
Binding residue
(residue number reindexed from 1)		L95 M214 I217 L218 G221 L222 P225 V228
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Cellular Component
GO:0005886 plasma membrane
GO:0016020 membrane

View graph for
Cellular Component
External links
PDB RCSB:8x2j, PDBe:8x2j, PDBj:8x2j
PDBsum8x2j
PubMed38299372
UniProtA9WEV4

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