5NRF

Crystal structure of human chitotriosidase-1 (hCHIT) catalytic domain in complex with compound 7i

Summary for 5NRF

Entry DOI	10.2210/pdb5nrf/pdb
Descriptor	Chitotriosidase-1, 1-(3-azanyl-1~{H}-1,2,4-triazol-5-yl)-~{N}-[2-(4-chlorophenyl)ethyl]-~{N}-(phenylmethyl)piperidin-4-amine, GLYCEROL, ... (4 entities in total)
Functional Keywords	chitotriosidase-1 (hchit) catalytic domain in complex with compound 7i, hydrolase
Biological source	Homo sapiens (Human)
Cellular location	Secreted: Q13231
Total number of polymer chains	1
Total formula weight	42727.33
Authors	Mazur, M.,Olczak, J.,Olejniczak, S.,Koralewski, R.,Czestkowski, W.,Jedrzejczak, A.,Golab, J.,Dzwonek, K.,Dymek, B.,Sklepkiewicz, P.,Zagozdzon, A.,Noonan, T.,Mahboubi, K.,Conway, B.,Sheeler, R.,Beckett, P.,Hungerford, W.M.,Podjarny, A.,Mitschler, A.,Cousido-Siah, A.,Fadel, F.,Golebiowski, A. (deposition date: 2017-04-22, release date: 2018-03-28)
Primary citation	Mazur, M.,Olczak, J.,Olejniczak, S.,Koralewski, R.,Czestkowski, W.,Jedrzejczak, A.,Golab, J.,Dzwonek, K.,Dymek, B.,Sklepkiewicz, P.L.,Zagozdzon, A.,Noonan, T.,Mahboubi, K.,Conway, B.,Sheeler, R.,Beckett, P.,Hungerford, W.M.,Podjarny, A.,Mitschler, A.,Cousido-Siah, A.,Fadel, F.,Golebiowski, A. Targeting Acidic Mammalian chitinase Is Effective in Animal Model of Asthma. J. Med. Chem., 61:695-710, 2018 Cited by PubMed: 29283260 DOI: 10.1021/acs.jmedchem.7b01051 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.447 Å)

Structure validation