Structure of PDB 7w2y Chain C Binding Site BS03
Receptor Information
>7w2y Chain C (length=156) Species:
9823
(Sus scrofa) [
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SRGEYVVAKLDDLVNWARRSSLWPMTFGLACCAVEMMHMAAPRYDMDRFG
VVFRASPRQSDVMIVAGTLTNKMAPALRKVYDQMPEPRYVVSMGSCANGG
GYYHYSYSVVRGCDRIVPVDIYVPGCPPTAEALLYGILQLQRKIKREKRL
RIWYRR
Ligand information
Ligand ID
DCQ
InChI
InChI=1S/C19H30O4/c1-5-6-7-8-9-10-11-12-13-15-14(2)16(20)18(22-3)19(23-4)17(15)21/h5-13H2,1-4H3
InChIKey
VMEGFMNVSYVVOM-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
O=C1C(=C(C(=O)C(OC)=C1OC)C)CCCCCCCCCC
OpenEye OEToolkits 1.5.0
CCCCCCCCCCC1=C(C(=O)C(=C(C1=O)OC)OC)C
CACTVS 3.341
CCCCCCCCCCC1=C(C)C(=O)C(=C(OC)C1=O)OC
Formula
C19 H30 O4
Name
2-decyl-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione;
decylubiquinone
ChEMBL
CHEMBL217894
DrugBank
DB07640
ZINC
ZINC000002575028
PDB chain
7w2y Chain C Residue 304 [
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Receptor-Ligand Complex Structure
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PDB
7w2y
The coupling mechanism of mammalian mitochondrial complex I.
Resolution
2.7 Å
Binding residue
(original residue number in PDB)
G68 A70 A73 M77
Binding residue
(residue number reindexed from 1)
G28 A30 A33 M37
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0008137
NADH dehydrogenase (ubiquinone) activity
GO:0048038
quinone binding
GO:0051536
iron-sulfur cluster binding
GO:0051539
4 iron, 4 sulfur cluster binding
View graph for
Molecular Function
External links
PDB
RCSB:7w2y
,
PDBe:7w2y
,
PDBj:7w2y
PDBsum
7w2y
PubMed
35145322
UniProt
A0A8D1TL60
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