Structure of PDB 7vyn Chain Q Binding Site BS03
Receptor Information
>7vyn Chain Q (length=386) Species:
9823
(Sus scrofa) [
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SNLTLNFGPQHPAAHGVLRLVMELSGEMVRKCDPHIGLLHRGTEKLIEYK
TYLQALPYFDRLDYVSMMCNEQAYSLAVEKLLNIQPPPRAQWIRVLFGEI
TRLLNHIMAVTTHALDIGAMTPFFWMFEEREKMFEFYERVSGARMHAAYI
RPGGVHQDLPLGLLDDIYEFSKNFSFRIDELEEMLTNNRIWRNRTVDIGV
VTAEDALNYGFSGVMLRGSGIQWDLRKTQPYDVYDQVEFDVPIGSRGDCY
DRYLCRVEEMRQSLRIISQCLNKMPPGEIKVDDAKVSPPKRAEMKTSMES
LIHHFKLYTEGYQVPPGATYTAIEAPKGEFGVYLVSDGSSRPYRCKIKAP
GFAHLAGLDKMSKGHMLADVVAIIGTQDIVFGEVDR
Ligand information
Ligand ID
UQ1
InChI
InChI=1S/C14H18O4/c1-8(2)6-7-10-9(3)11(15)13(17-4)14(18-5)12(10)16/h6H,7H2,1-5H3
InChIKey
SOECUQMRSRVZQQ-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
COC1=C(OC)C(=O)C(=C(C)C1=O)CC=C(C)C
OpenEye OEToolkits 1.5.0
CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)C
ACDLabs 10.04
O=C1C(=C(C(=O)C(OC)=C1OC)C)C\C=C(/C)C
Formula
C14 H18 O4
Name
UBIQUINONE-1
ChEMBL
CHEMBL1236594
DrugBank
DB08689
ZINC
ZINC000001559692
PDB chain
7vyn Chain Q Residue 501 [
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Receptor-Ligand Complex Structure
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PDB
7vyn
The coupling mechanism of mammalian mitochondrial complex I.
Resolution
2.4 Å
Binding residue
(original residue number in PDB)
H92 G93 Y141 T189
Binding residue
(residue number reindexed from 1)
H15 G16 Y64 T112
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0016651
oxidoreductase activity, acting on NAD(P)H
GO:0048038
quinone binding
GO:0051287
NAD binding
View graph for
Molecular Function
External links
PDB
RCSB:7vyn
,
PDBe:7vyn
,
PDBj:7vyn
PDBsum
7vyn
PubMed
35145322
UniProt
F1S1A8
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