Brand  (β version)

PDB ID: 3O95

Hetero Atom Contents

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hetatm:

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centroid:
interaction residue:

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Ligands
Code Name Link
01T [5-(aminomethyl)-6-(2,2-dimethylpropyl)-2-ethyl-4-(4-methylphenyl)pyridin-3-yl]acetic acid PoSSuM
NAG 2-acetamido-2-deoxy-beta-D-glucopyranose PoSSuM

Structure summary

Code : 3O95   PDBj   RCSB PDB   PDBe
Header : HYDROLASE,SIGNALING PROTEIN/INHIBITOR
Title : Crystal Structure of Human DPP4 Bound to TAK-100
Release Data : 2011-01-26
Compound :
mol_id molecule chains synonym
1 Dipeptidyl peptidase 4 A,B,C,D Dipeptidyl peptidase IV, DPP IV, T-cell activation antigen CD26, TP103, Adenosine deaminase complexing protein 2, ADCP-2, ADABP
ec: 3.4.14.5
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Spodoptera frugiperda  (taxid:7108)
gene: ADCP2, CD26, DPP4
expression_system_common: Fall armyworm
expression_system_cell_line: SF9
expression_system_vector_type: Baculovirus
expression_system_plasmid: pFASTBAC
Authors : Yano, J.K., Aertgeerts, K.
Keywords : protease and 8-bladed beta-propeller domain, Aminopeptidase, Cell membrane, Glycoprotein, Hydrolase, Membrane, Protease, Secreted, Serine protease, Signal-anchor, Transmembrane, SIGNALING PROTEIN, SIGNALING PROTEIN-INHIBITOR complex
Exp. method : X-RAY DIFFRACTION ( 2.8500 Å )
Citation :

Discovery of a 3-Pyridylacetic Acid Derivative (TAK-100) as a Potent, Selective and Orally Active Dipeptidyl Peptidase IV (DPP-4) Inhibitor.

Miyamoto, Y.,Banno, Y.,Yamashita, T.  et al.
(2011)  J.Med.Chem.  53 : 3517 - 3531

PubMed: 21218817
DOI: 10.1021/jm101236h

Reaction

Chain : A, B, C, D
UniProt : P27487 (DPP4_HUMAN)
Reaction : Reaction=Release of an N-terminal dipeptide, Xaa-Yaa-|-Zaa-, from a polypeptide, preferentially when Yaa is Pro, provided Zaa is neither Pro nor hydroxyproline.; EC=3.4.14.5; Evidence={ECO:0000255|PROSITE- ProRule:PRU10084, ECO:0000269|PubMed:10593948};