7MFH

Crystal structure of BIO-32546 bound mouse Autotaxin

Summary for 7MFH

• Entry DOI: 10.2210/pdb7mfh/pdb
• Descriptor: Ectonucleotide pyrophosphatase/phosphodiesterase family member 2, alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-alpha-D-mannopyranose-(1-6)-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: hydrolase inhibitor, autotaxin, hydrolase, hydrolase-inhibitor complex, hydrolase/inhibitor
• Biological source: Mus musculus (Mouse)
• Total number of polymer chains: 1
• Total formula weight: 99445.25

Authors

Chodaparambil, J.V. (deposition date: 2021-04-09, release date: 2022-04-13, Last modification date: 2023-10-18)

• Primary citation: Ma, B.,Zhang, L.,Sun, L.,Xin, Z.,Kumaravel, G.,Marcotte, D.,Chodaparambil, J.V.,Wang, Q.,Wehr, A.,Jing, J.,Hong, V.S.,Wang, T.,Huang, C.,Shao, Z.,Mi, S.; Discovery of Potent Selective Nonzinc Binding Autotaxin Inhibitor BIO-32546.; Acs Med.Chem.Lett., 12:1124-1129, 2021; PubMed: 34267882; DOI: 10.1021/acsmedchemlett.1c00211

Experimental method

X-RAY DIFFRACTION (2.3 Å)