5INH

Crystal structure of Autotaxin/ENPP2 with a covalent fragment

Summary for 5INH

Entry DOI	10.2210/pdb5inh/pdb
Descriptor	Ectonucleotide pyrophosphatase/phosphodiesterase family member 2, alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ... (9 entities in total)
Functional Keywords	inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Mus musculus (Mouse)
Total number of polymer chains	1
Total formula weight	102907.16
Authors	Klein, M.G.,Tjhen, R. (deposition date: 2016-03-07, release date: 2017-03-15, Last modification date: 2020-07-29)
Primary citation	Lanier, M.,Cole, D.C.,Istratiy, Y.,Klein, M.G.,Schwartz, P.A.,Tjhen, R.,Jennings, A.,Hixon, M.S. Repurposing Suzuki Coupling Reagents as a Directed Fragment Library Targeting Serine Hydrolases and Related Enzymes. J. Med. Chem., 60:5209-5215, 2017 Cited by PubMed: 28564542 DOI: 10.1021/acs.jmedchem.6b01224 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.84 Å)

Structure validation