7B9L

MEK1 in complex with compound 23

Summary for 7B9L

• Entry DOI: 10.2210/pdb7b9l/pdb
• Descriptor: Dual specificity mitogen-activated protein kinase kinase 1,Dual specificity mitogen-activated protein kinase kinase 1, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ~{N}-(4-methoxyphenyl)-2-[(2~{S})-3-oxidanylidenethiomorpholin-2-yl]ethanamide, ... (7 entities in total)
• Functional Keywords: kinase, allosteric, fragments, transferase
• Biological source: Homo sapiens (Human); More
• Total number of polymer chains: 2
• Total formula weight: 74925.85

Authors

Kack, H.,Oster, L. (deposition date: 2020-12-14, release date: 2021-03-03, Last modification date: 2024-01-31)

• Primary citation: Di Fruscia, P.,Edfeldt, F.,Shamovsky, I.,Collie, G.W.,Aagaard, A.,Barlind, L.,Borjesson, U.,Hansson, E.L.,Lewis, R.J.,Nilsson, M.K.,Oster, L.,Pemberton, J.,Ripa, L.,Storer, R.I.,Kack, H.; Fragment-Based Discovery of Novel Allosteric MEK1 Binders.; Acs Med.Chem.Lett., 12:302-308, 2021; PubMed: 33603979; DOI: 10.1021/acsmedchemlett.0c00563

Experimental method

X-RAY DIFFRACTION (1.7 Å)