PPIRE03707

Target Protein Information
Protein_Name Estrogen receptor beta
Protein_Sequence MDIKNSPSSLNSPSSYNCSQSILPLEHGSIYIPSSYVDSHHEYPAMTFYSPAVMNYSIPSNVTNLEGGPGRQTTSPNVLWPTPGHLSPLVVHRQLSHLYAEPQKSPWCEARSLEHTLPVNRETLKRKVSGNRCASPVTGPGSKRDAHFCAVCSDYASGYHYGVWSCEGCKAFFKRSIQGHNDYICPATNQCTIDKNRRKSCQACRLRKCYEVGMVKCGSRRERCGYRLVRRQRSADEQLHCAGKAKRSGGHAPRVRELLLDALSPEQLVLTLLEAEPPHVLISRPSAPFTEASMMMSLTKLADKELVHMISWAKKIPGFVELSLFDQVRLLESCWMEVLMMGLMWRSIDHPGKLIFAPDLVLDRDEGKCVEGILEIFDMLLATTSRFRELKLQHKEYLCVKAMILLNSSMYPLVTATQDADSSRKLAHLLNAVTDALVWVIAKSGISSQQQSMRLANLLMLLSHVRHASNKGMEHLLNMKCKNVVPVYDLLLEMLNAHVLRGCKSSITGSECSPAEDSKSKEGSQNPQSQ
Organism_Source Homo sapiens
Functional_Classification Receptor
Cellular_Localization Nucleus
Gene_Names ESR2
UniProt_ID Q92731
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name EMP-2
Peptide_Sequence VSWFFED
Peptide_Length 7
Peptide_SMILES CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O
Chemical_Modification None
Cyclization_Method None
Linear/Cyclic Linear
N-terminal_Modification Free
C-terminal_Modification Free
Amino_Acid_Distribution
Peptide Physicochemical
Molecular_Weight 929.00
Aliphatic_Index 41.42857
Aromaticity 0.42857
Average_Rotatable_Bonds 3.71429
Charge_at_pH_7 -1.99979
Isoelectric_Point 3.55007
Number_of_Hydrogen_Bond_Acceptors 11
Number_of_Hydrogen_Bond_Donors 12
Topological_Polar_Surface_Area 348.54000
X_logP_energy -0.49570
Interaction Information
Affinity IC50=125 uM
Affinity_Assay Estrogen receptor binding assay
PDB_ID None
Type antagonist
Structure
Reference Information
Document_Type Research Articles
Title Design, synthesis, and evaluation of peptides with estrogen-like activity.
Release_Year 2004
PMID 15468062
DOI 10.1002/bip.20133