PPIRE07588

Target Protein Information
Protein_Name Angiotensin-converting enzyme
Protein_Sequence MRLFLLALLATLAVTQALVKEEIQAKEYLENLNKELAKRTNVETEAAWAYGSNITDENEKKKNEISAELAKFMKEVASDTTKFQWRSYQSEDLKRQFKALTKLGYAALPEDDYAELLDTLSAMESNFAKVKVCDYKDSTKCDLALDPEIEEVISKSRDHEELAYYWREFYDKAGTAVRSQFERYVELNTKAAKLNNFTSGAEAWLDEYEDDTFEQQLEDIFADIRPLYQQIHGYVRFRLRKHYGDAVVSETGPIPMHLLGNMWAQQWSEIADIVSPFPEKPLVDVSAEMEKQGYTPLKMFQMGDDFFTSMNLTKLPQDFWDKSIIEKPTDGRDLVCHASAWDFYLTDDVRIKQCTRVTQDQLFTVHHELGHIQYFLQYQHQPFVYRTGANPGFHEAVGDVLSLSVSTPKHLEKIGLLKDYVRDDEARINQLFLTALDKIVFLPFAFTMDKYRWSLFRGEVDKANWNCAFWKLRDEYSGIEPPVVRSEKDFDAPAKYHISADVEYLRYLVSFIIQFQFYKSACIKAGQYDPDNVELPLDNCDIYGSAAAGAAFHNMLSMGASKPWPDALEAFNGERIMSGKAIAEYFEPLRVWLEAENIKNNVHIGWTTSNKCVSS
Organism_Source Drosophila melanogaster
Functional_Classification zinc-dependent exopeptidase
Cellular_Localization Extracellular
Gene_Names Ance
UniProt_ID Q10714
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name Ang II
Peptide_Sequence DRVYIHPF
Peptide_Length 8
Peptide_SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)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 1046.19
Aliphatic_Index 85.00000
Aromaticity 0.25000
Average_Rotatable_Bonds 3.62500
Charge_at_pH_7 0.08849
Isoelectric_Point 7.54296
Number_of_Hydrogen_Bond_Acceptors 13
Number_of_Hydrogen_Bond_Donors 14
Topological_Polar_Surface_Area 406.34000
X_logP_energy -1.10503
Interaction Information
Affinity Ki=76 uM
Affinity_Assay Enzyme Inhibition Kinetics
PDB_ID 4AA1
Type Inhibitor
Structure
Reference Information
Document_Type Research Articles
Title Structural basis of peptide recognition by the angiotensin-1 converting enzyme homologue AnCE from Drosophila?melanogaster.
Release_Year 2012
PMID 23082758
DOI 10.1111/febs.12038