6JK6
Crystal structure of human chitotriosidase-1 (hCHIT) catalytic domain in complex with compound 2-8-s2
Summary for 6JK6
Entry DOI | 10.2210/pdb6jk6/pdb |
Descriptor | Chitotriosidase-1, 6-azanyl-11-methyl-2-oxidanylidene-7-[[(2R)-oxolan-2-yl]methyl]-N-(pyridin-3-ylmethyl)-1,9-diaza-7-azoniatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,6,9,11,13-hexaene-5-carboxamide (3 entities in total) |
Functional Keywords | chitnase, complex, chitotriosidase, hydrolase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 43559.72 |
Authors | |
Primary citation | Jiang, X.,Kumar, A.,Motomura, Y.,Liu, T.,Zhou, Y.,Moro, K.,Zhang, K.Y.J.,Yang, Q. A Series of Compounds Bearing a Dipyrido-Pyrimidine Scaffold Acting as Novel Human and Insect Pest Chitinase Inhibitors. J.Med.Chem., 63:987-1001, 2020 Cited by PubMed: 31928006DOI: 10.1021/acs.jmedchem.9b01154 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.571 Å) |
Structure validation
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