6B2P

Dual Inhibition of the Essential Protein Kinases A and B in Mycobacterium tuberculosis

6B2P の概要

• エントリーDOI: 10.2210/pdb6b2p/pdb
• 分子名称: Serine/threonine-protein kinase PknB, 5-{5-chloro-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl}thiophene-2-sulfonamide (2 entities in total)
• 機能のキーワード: kinase, drug design, tuberculosis, transferase-inhibitor complex, transferase/inhibitor
• 由来する生物種: Mycobacterium tuberculosis
• 細胞内の位置: Cell membrane ; Single-pass membrane protein : P9WI80
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 30684.03

構造登録者

Zuccola, H.J. (登録日: 2017-09-20, 公開日: 2018-02-14, 最終更新日: 2024-03-13)

• 主引用文献: Wang, T.,Bemis, G.,Hanzelka, B.,Zuccola, H.,Wynn, M.,Moody, C.S.,Green, J.,Locher, C.,Liu, A.,Gao, H.,Xu, Y.,Wang, S.,Wang, J.,Bennani, Y.L.,Thomson, J.A.,Muh, U.; Mtb PKNA/PKNB Dual Inhibition Provides Selectivity Advantages for Inhibitor Design To Minimize Host Kinase Interactions.; ACS Med Chem Lett, 8:1224-1229, 2017; PubMed: 29259738; DOI: 10.1021/acsmedchemlett.7b00239

実験手法

X-RAY DIFFRACTION (3.01 Å)