6WPP

HUMAN NIK IN COMPLEX WITH LIGAND COMPOUND X

Summary for 6WPP

• Entry DOI: 10.2210/pdb6wpp/pdb
• Descriptor: Mitogen-activated protein kinase kinase kinase 14, 5-fluoro-N-methyl-2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-4-amine (3 entities in total)
• Functional Keywords: nf-kappab signaling, immune system
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 76411.10

Authors

Shih, A.Y.,Hack, M.,Mirzadegan, T. (deposition date: 2020-04-27, release date: 2020-08-26, Last modification date: 2024-03-06)

• Primary citation: Shih, A.Y.,Hack, M.,Mirzadegan, T.; Impact of Protein Preparation on Resulting Accuracy of FEP Calculations.; J.Chem.Inf.Model., 60:5287-5289, 2020; PubMed: 32786514; DOI: 10.1021/acs.jcim.0c00445

Experimental method

X-RAY DIFFRACTION (2.55 Å)