PPIRE03651

Target Protein Information
Protein_Name Alpha-parvin
Protein_Sequence MATSPQKSPSVPKSPTPKSPPSRKKDDSFLGKLGGTLARRKKAKEVSELQEEGMNAINLPLSPIPFELDPEDTMLEENEVRTMVDPNSRSDPKLQELMKVLIDWINDVLVGERIIVKDLAEDLYDGQVLQKLFEKLESEKLNVAEVTQSEIAQKQKLQTVLEKINETLKLPPRSIKWNVDSVHAKSLVAILHLLVALSQYFRAPIRLPDHVSIQVVVVQKREGILQSRQIQEEITGNTEALSGRHERDAFDTLFDHAPDKLNVVKKTLITFVNKHLNKLNLEVTELETQFADGVYLVLLMGLLEGYFVPLHSFFLTPDSFEQKVLNVSFAFELMQDGGLEKPKPRPEDIVNCDLKSTLRVLYNLFTKYRNVE
Organism_Source Homo sapiens
Functional_Classification other
Cellular_Localization Cytoplasm
Gene_Names PARVA
UniProt_ID Q9NVD7
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name None
Peptide_Sequence DLDALLADLE
Peptide_Length 10
Peptide_SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=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 1087.19
Aliphatic_Index 176.00000
Aromaticity 0.00000
Average_Rotatable_Bonds 3.60000
Charge_at_pH_7 -3.99890
Isoelectric_Point 3.26047
Number_of_Hydrogen_Bond_Acceptors 15
Number_of_Hydrogen_Bond_Donors 15
Topological_Polar_Surface_Area 474.42000
X_logP_energy -2.72540
Interaction Information
Affinity KD=1.2 uM
Affinity_Assay NMR chemical shift perturbation
PDB_ID 2K2R
Type Affinity ligand
Structure
Reference Information
Document_Type Research Articles
Title Development of QSAR-Improved Statistical Potential for the Structure-Based Analysis of Protein?Peptide Binding Affinities.
Release_Year 2013
PMID 27480231
DOI 10.1002/minf.201300064