PPIRE15136

Target Protein Information
Protein_Name Casein kinase II subunit alpha
Protein_Sequence MSGPVPSRARVYTDVNTHRPREYWDYESHVVEWGNQDDYQLVRKLGRGKYSEVFEAINITNNEKVVVKILKPVKKKKIKREIKILENLRGGPNIITLADIVKDPVSRTPALVFEHVNNTDFKQLYQTLTDYDIRFYMYEILKALDYCHSMGIMHRDVKPHNVMIDHEHRKLRLIDWGLAEFYHPGQEYNVRVASRYFKGPELLVDYQMYDYSLDMWSLGCMLASMIFRKEPFFHGHDNYDQLVRIAKVLGTEDLYDYIDKYNIELDPRFNDILGRHSRKRWERFVHSENQHLVSPEALDFLDKLLRYDHQSRLTAREAMEHPYFYTVVKDQARMGSSSMPGGSTPVSSANMMSGISSVPTPSPLGPLAGSPVIAAANPLGMPVPAAAGAQQ
Organism_Source Homo sapiens
Functional_Classification serine threonine protein kinases
Cellular_Localization Cytoplasm
Gene_Names CSNK2A1
UniProt_ID P68400
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name linear Pc
Peptide_Sequence GAGGRLYGFKIHGGP
Peptide_Length 15
Peptide_SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=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 1486.70
Aliphatic_Index 58.66667
Aromaticity 0.13333
Average_Rotatable_Bonds 3.06667
Charge_at_pH_7 2.08774
Isoelectric_Point 10.45503
Hydrogen_Bond_Acceptors 20
Hydrogen_Bond_Donors 21
Topological_Polar_Surface_Area 598.76000
X_logP_energy -5.85873
Interaction Information
Affinity IC50=30 uM
Affinity_Assay Competition binding assay
PDB_ID 1JWH
Type Inhibitor
Structure
Reference Information
Document_Type Research Articles
Title Structure-based design of small peptide inhibitors of protein kinase CK2 subunit interaction
Release_Year 2007
PMID 17714077
DOI 10.1042/BJ20070825