Structure of PDB 6tdu Chain p Binding Site BS01

Receptor Information
>6tdu Chain p (length=114) Species: 3039 (Euglena gracilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AAPAEKPDPALDATKALPKALEEVEFFQSYAVRRKTGFHLFNRATGSPTI
VGPMFYNLYNFVRIGRVSKYVCWLSLPLVFQRMWMKNRATGMEYDIDLEN
YAPFEAKKNPMHGH
Ligand information
Ligand IDTRT
InChIInChI=1S/C21H36O4/c1-20(2,3)17-21(4,5)18-7-9-19(10-8-18)25-16-15-24-14-13-23-12-11-22-6/h7-10H,11-17H2,1-6H3
InChIKeyHEUDUECKTWTQQR-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O(c1ccc(cc1)C(C)(C)CC(C)(C)C)CCOCCOCCOC
CACTVS 3.341COCCOCCOCCOc1ccc(cc1)C(C)(C)CC(C)(C)C
OpenEye OEToolkits 1.5.0CC(C)(C)CC(C)(C)c1ccc(cc1)OCCOCCOCCOC
FormulaC21 H36 O4
NameFRAGMENT OF TRITON X-100;
1-{2-[2-(2-METHOXYETHOXY)ETHOXY]ETHOXY}-4-(1,1,3,3-TETRAMETHYLBUTYL)BENZENE
ChEMBL
DrugBankDB02080
ZINCZINC000005885272
PDB chain6tdu Chain p Residue 202 [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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PDB6tdu Structure of a mitochondrial ATP synthase with bound native cardiolipin.
Resolution4.32 Å
Binding residue
(original residue number in PDB)		P59 M60
Binding residue
(residue number reindexed from 1)		P53 M54
Annotation score1
External links