5WQJ

Crystal structure of 3-Mercaptopyruvate Sulfurtransferase(3MST) in complex with compound1

Summary for 5WQJ

• Entry DOI: 10.2210/pdb5wqj/pdb
• Related: 5WQK
• Descriptor: Sulfurtransferase, 2-[2-[(4-oxidanylidene-3~{H}-quinazolin-2-yl)sulfanyl]ethanoylamino]thiophene-3-carboxamide, SODIUM ION, ... (4 entities in total)
• Functional Keywords: transferase-inhibitor complex, transferase/inhibitor
• Biological source: Mus musculus (Mouse)
• Total number of polymer chains: 2
• Total formula weight: 66969.93

Authors

Suwanai, Y.,Toma-Fukai, S.,Shimizu, T. (deposition date: 2016-11-27, release date: 2017-09-06)

• Primary citation: Hanaoka, K.,Sasakura, K.,Suwanai, Y.,Toma-Fukai, S.,Shimamoto, K.,Takano, Y.,Shibuya, N.,Terai, T.,Komatsu, T.,Ueno, T.,Ogasawara, Y.,Tsuchiya, Y.,Watanabe, Y.,Kimura, H.,Wang, C.,Uchiyama, M.,Kojima, H.,Okabe, T.,Urano, Y.,Shimizu, T.,Nagano, T.; Discovery and Mechanistic Characterization of Selective Inhibitors of H2S-producing Enzyme: 3-Mercaptopyruvate Sulfurtransferase (3MST) Targeting Active-site Cysteine Persulfide; Sci Rep, 7:40227-40227, 2017; PubMed: 28079151; DOI: 10.1038/srep40227

Experimental method

X-RAY DIFFRACTION (1.2 Å)