PPIRE06597

Target Protein Information
Protein_Name cAMP-dependent protein kinase catalytic subunit alpha
Protein_Sequence MGNAAAAKKGSEQESVKEFLAKAKEDFLKKWESPAQNTAHLDQFERIKTLGTGSFGRVMLVKHKETGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVPGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFSEF
Organism_Source Homo sapiens
Functional_Classification kinases
Cellular_Localization Cytoplasm
Gene_Names PRKACA
UniProt_ID P17612
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name ARC-670
Peptide_Sequence rrrrrr
Peptide_Length 6
Peptide_SMILES N=C(N)NCCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O
Chemical_Modification None
Cyclization_Method None
Linear/Cyclic Linear
N-terminal_Modification Free
C-terminal_Modification amide
Amino_Acid_Distribution
Peptide Physicochemical
Molecular_Weight 955.14
Aliphatic_Index 0.00000
Aromaticity 0.00000
Average_Rotatable_Bonds 5.83333
Charge_at_pH_7 5.99796
Isoelectric_Point 13.19898
Number_of_Hydrogen_Bond_Acceptors 13
Number_of_Hydrogen_Bond_Donors 25
Topological_Polar_Surface_Area 580.22000
X_logP_energy -7.59808
Interaction Information
Affinity KD=0.82 nM
Affinity_Assay time-resolved luminescence displacement assay
PDB_ID None
Type Inhibitor
Structure
Reference Information
Document_Type Research Articles
Title Bifunctional Ligands for Inhibition of Tight-Binding Protein-Protein Interactions.
Release_Year 2016
PMID 27389935
DOI 10.1021/acs.bioconjchem.6b00293