Structure of PDB 8ib4 Chain B Binding Site BS02

Receptor Information
>8ib4 Chain B (length=157) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RSRAEYVVTKLDDLINWARRSSLWPMTFGLACCAVEMMHMAAPRYDMDRF
GVVFRASPRQADVMIVAGTLTNKMAPALRKVYDQMPEPRYVVSMGSCANG
GGYYHYSYSVVRGCDRIVPVDIYVPGCPPTAEALLYGILQLQRKIKREQK
LKIWYRR
Ligand information
Ligand IDUQ1
InChIInChI=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
InChIKeySOECUQMRSRVZQQ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341COC1=C(OC)C(=O)C(=C(C)C1=O)CC=C(C)C
OpenEye OEToolkits 1.5.0CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)C
ACDLabs 10.04O=C1C(=C(C(=O)C(OC)=C1OC)C)C\C=C(/C)C
FormulaC14 H18 O4
NameUBIQUINONE-1
ChEMBLCHEMBL1236594
DrugBankDB08689
ZINCZINC000001559692
PDB chain8ib4 Chain B Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8ib4 Respiratory complex CI:CIII2, type IA, Wild type mouse under cold temperature
Resolution4.3 Å
Binding residue
(original residue number in PDB)		T94 G96 A101 M104 M105 F121 R122
Binding residue
(residue number reindexed from 1)		T27 G29 A34 M37 M38 F54 R55
Annotation score1
External links
PDB RCSB:8ib4, PDBe:8ib4, PDBj:8ib4
PDBsum8ib4
PubMed
UniProtQ9DC70|NDUS7_MOUSE NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial (Gene Name=Ndufs7)

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