4L6Q

ROCK2 in complex with benzoxaborole

Summary for 4L6Q

Entry DOI	10.2210/pdb4l6q/pdb
Descriptor	Rho-associated protein kinase 2, 6-[4-(aminomethyl)-2-fluorophenoxy]-2,1-benzoxaborol-1(3H)-ol (3 entities in total)
Functional Keywords	transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Homo sapiens (human)
Cellular location	Cytoplasm: O75116
Total number of polymer chains	2
Total formula weight	92346.38
Authors	Rock, F.,Jarnagin, K. (deposition date: 2013-06-12, release date: 2013-10-02, Last modification date: 2024-02-28)
Primary citation	Akama, T.,Dong, C.,Virtucio, C.,Sullivan, D.,Zhou, Y.,Zhang, Y.K.,Rock, F.,Freund, Y.,Liu, L.,Bu, W.,Wu, A.,Fan, X.Q.,Jarnagin, K. Linking phenotype to kinase: identification of a novel benzoxaborole hinge-binding motif for kinase inhibition and development of high-potency rho kinase inhibitors. J.Pharmacol.Exp.Ther., 347:615-625, 2013 Cited by PubMed: 24049062 DOI: 10.1124/jpet.113.207662 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.79 Å)

Structure validation