4LKO
Name : Crystal structure of human DPP-IV in complex with BMS-744891
Revelation date : 04-Sep-2013
Family : DPP4N_Peptidase_S9
Gene_locus : human-DPP4
PDB file : ESTHER: header of PDB entry RCSB: Full entry
Comment
Klei, H.E.
Ligand : Inhibitor BMS-744891 Ligand in structure: Ligplot
References (1)
| Title : Optimization of Activity, Selectivity, and Liability Profiles in 5-Oxopyrrolopyridine DPP4 Inhibitors Leading to Clinical Candidate (Sa)-2-(3-(Aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl-5-oxo-5H-pyrrolo[3,4-b]py ridin-6(7H)-yl)-N,N-dimethylacetamide (BMS-767778) - Devasthale_2013_J.Med.Chem_56_7343 |
| Author(s) : Devasthale P , Wang Y , Wang W , Fevig J , Feng J , Wang A , Harrity T , Egan D , Morgan N , Cap M , Fura A , Klei HE , Kish K , Weigelt C , Sun L , Levesque P , Moulin F , Li YX , Zahler R , Kirby MS , Hamann LG |
| Ref : Journal of Medicinal Chemistry , 56 :7343 , 2013 |
| Abstract : |
| PubMedSearch : Devasthale_2013_J.Med.Chem_56_7343 |
| PubMedID: 23964740 |
| Gene_locus related to this paper: human-DPP4 |
Representative scheme of Prolylcarboxypeptidase structure and an image from PDBsum server
Databases
PDB-Sum : 4LKO Previously Class, Architecture, Topology and Homologous superfamily - PDB-Sum server
FSSP : 4LKO Fold classification based on Structure-Structure alignment of Proteins - FSSP server
SCOP : 4LKO Structural Classification Of Protein - SCOP server
PROTEOPEDIA : 4LKO 3D, interactive encyclopedia of proteins - PROTEOPEDIA server