PPIRE04332

Target Protein Information
Protein_Name Periplasmic oligopeptide-binding protein OppA
Protein_Sequence MTNITKRSLVAAGVLAALMAGNVALAADVPAGVTLAEKQTLVRNNGSEVQSLDPHKIEGVPESNISRDLFEGLLVSDLDGHPAPGVAESWDNKDAKVWTFHLRKDAKWSDGTPVTAQDFVYSWQRSVDPNTASPYASYLQYGHIAGIDEILEGKKPITDLGVKAIDDHTLEVTLSEPVPYFYKLLVHPSTSPVPKAAIEKFGEKWTQPGNIVTNGAYTLKDWVVNERIVLERSPTYWNNAKTVINQVTYLPIASEVTDVNRYRSGEIDMTNNSMPIELFQKLKKEIPDEVHVDPYLCTYYYEINNQKPPFNDVRVRTALKLGMDRDIIVNKVKAQGNMPAYGYTPPYTDGAKLTQPEWFGWSQEKRNEEAKKLLAEAGYTADKPLTINLLYNTSDLHKKLAIAASSLWKKNIGVNVKLVNQEWKTFLDTRHQGTFDVARAGWCADYNEPTSFLNTMLSNSSMNTAHYKSPAFDSIMAETLKVTDEAQRTALYTKAEQQLDKDSAIVPVYYYVNARLVKPWVGGYTGKDPLDNTYTRNMYIVKH
Organism_Source Escherichia coli (strain K12)
Functional_Classification periplasmic binding proteins
Cellular_Localization Extracellular
Gene_Names oppA
UniProt_ID P23843
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name Lys-Nva-Lys
Peptide_Sequence KXK
Peptide_Length 3
Peptide_SMILES NCCCC[C@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)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 331.42
Aliphatic_Index 0.00000
Aromaticity 0.00000
Average_Rotatable_Bonds 4.33333
Charge_at_pH_7 1.99739
Isoelectric_Point 10.80538
Number_of_Hydrogen_Bond_Acceptors 6
Number_of_Hydrogen_Bond_Donors 6
Topological_Polar_Surface_Area 173.56000
X_logP_energy -1.74270
Interaction Information
Affinity KD=15 nM
Affinity_Assay Isothermal titration calorimetry
PDB_ID 1B6H
Type Affinity ligand
Structure
Reference Information
Document_Type Research Articles
Title Relating structure to thermodynamics: the crystal structures and binding affinity of eight OppA-peptide complexes.
Release_Year 1999
PMID 10422831
DOI 10.1110/ps.8.7.1432