Root mean square deviations (rmsd) between deposited and re-refined structures of 20 amino acid residues in the active site of DPP-4 complexes.
Sundaram Arulmozhiraja
Naoya Matsuo
Erika Ishitsubo
Seiji Okazaki
Hitoshi Shimano
Hiroaki Tokiwa
10.1371/journal.pone.0166275.s001
https://plos.figshare.com/articles/journal_contribution/Comparative_Binding_Analysis_of_Dipeptidyl_Peptidase_IV_DPP-4_with_Antidiabetic_Drugs_An_i_Ab_Initio_i_Fragment_Molecular_Orbital_Study/4226399
<p>All values are in Å.</p> <p>(DOCX)</p>
2016-11-10 17:35:48
Comparative Binding Analysis
interfragment interaction energies
type 2 diabetics
DPP -4
Ab Initio Fragment Molecular Orbital Study Dipeptidyl peptidase IV
Dipeptidyl Peptidase IV
RI-MP
binding
DPP -4 inhibitors
S 2
S 1 subsite
IC