5Y9L

Human kallikrein 7 in complex with 1,3,6-trisubstituted 1,4-diazepane-7-one

Summary for 5Y9L

Entry DOI	10.2210/pdb5y9l/pdb
Descriptor	Kallikrein-7, 3-[2-[(3Z,6R)-6-[(5-chloranyl-2-methoxy-phenyl)methyl]-3-(dimethylhydrazinylidene)-7-oxidanylidene-1,4-diazepan-1-yl]ethanoylamino]benzoic acid, CHLORIDE ION, ... (4 entities in total)
Functional Keywords	protease, inhibitor complex, hydrolase
Biological source	Homo sapiens (Human)
Cellular location	Secreted : P49862
Total number of polymer chains	1
Total formula weight	25018.58
Authors	Sugawara, H. (deposition date: 2017-08-25, release date: 2017-11-29, Last modification date: 2023-11-22)
Primary citation	Murafuji, H.,Sakai, H.,Goto, M.,Imajo, S.,Sugawara, H.,Muto, T. Discovery and structure-activity relationship study of 1,3,6-trisubstituted 1,4-diazepane-7-ones as novel human kallikrein 7 inhibitors Bioorg. Med. Chem. Lett., 27:5272-5276, 2017 Cited by PubMed: 29102227 DOI: 10.1016/j.bmcl.2017.10.030 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.15 Å)

Structure validation