Structure of PDB 4tpr Chain H Binding Site BS01

Receptor Information
>4tpr Chain H (length=221) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EVQLQQSGAEIVRSGASVKLSCAASGFNIKDYYMHWVKQRPEQGLEWIGW
IDPENGDIAYAPKFQGKATMTADTSSNTAYLQLSRLTSEDTAVYFCNGRG
GMITTDFFDYWGQGTTLTVSSAKTTPPSVYPLAPGSAAQTNSMVTLGCLV
KGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSET
VTCNVAHPASSTKVDKKIVPR
Ligand information
Ligand ID33O
InChIInChI=1S/C26H54O14/c27-1-3-29-5-7-31-9-11-33-13-15-35-17-19-37-21-23-39-25-26-40-24-22-38-20-18-36-16-14-34-12-10-32-8-6-30-4-2-28/h27-28H,1-26H2
InChIKeyAKWFJQNBHYVIPY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01O(CCOCCOCCOCCOCCOCCO)CCOCCOCCOCCOCCOCCOCCO
OpenEye OEToolkits 1.9.2C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
CACTVS 3.385OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
FormulaC26 H54 O14
Name3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxaoctatriacontane-1,38-diol;
Tridecaethyleneglycol
ChEMBL
DrugBank
ZINCZINC000100008458
PDB chain4tpr Chain H Residue 304 [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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PDB4tpr Structure of Tau5 antibody Fab fragment
Resolution1.6 Å
Binding residue
(original residue number in PDB)		N163 L167 V191 T195 K213 D215
Binding residue
(residue number reindexed from 1)		N163 L167 V191 T195 K213 D215
Annotation score1
External links