8TQD

NF-Kappa-B1 Bound with a Covalent Inhibitor

Summary for 8TQD

• Entry DOI: 10.2210/pdb8tqd/pdb
• Descriptor: Nuclear factor NF-kappa-B p105 subunit, 1-(2-bromo-4-chlorophenyl)-N-{(3S)-1-[(E)-iminomethyl]pyrrolidin-3-yl}methanesulfonamide (3 entities in total)
• Functional Keywords: transcription factor, dna binding protein, transcription
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 1
• Total formula weight: 23118.84

Authors

Hilbert, B.J. (deposition date: 2023-08-07, release date: 2024-04-24, Last modification date: 2024-05-22)

• Primary citation: Takahashi, M.,Chong, H.B.,Zhang, S.,Yang, T.Y.,Lazarov, M.J.,Harry, S.,Maynard, M.,Hilbert, B.,White, R.D.,Murrey, H.E.,Tsou, C.C.,Vordermark, K.,Assaad, J.,Gohar, M.,Durr, B.R.,Richter, M.,Patel, H.,Kryukov, G.,Brooijmans, N.,Alghali, A.S.O.,Rubio, K.,Villanueva, A.,Zhang, J.,Ge, M.,Makram, F.,Griesshaber, H.,Harrison, D.,Koglin, A.S.,Ojeda, S.,Karakyriakou, B.,Healy, A.,Popoola, G.,Rachmin, I.,Khandelwal, N.,Neil, J.R.,Tien, P.C.,Chen, N.,Hosp, T.,van den Ouweland, S.,Hara, T.,Bussema, L.,Dong, R.,Shi, L.,Rasmussen, M.Q.,Domingues, A.C.,Lawless, A.,Fang, J.,Yoda, S.,Nguyen, L.P.,Reeves, S.M.,Wakefield, F.N.,Acker, A.,Clark, S.E.,Dubash, T.,Kastanos, J.,Oh, E.,Fisher, D.E.,Maheswaran, S.,Haber, D.A.,Boland, G.M.,Sade-Feldman, M.,Jenkins, R.W.,Hata, A.N.,Bardeesy, N.M.,Suva, M.L.,Martin, B.R.,Liau, B.B.,Ott, C.J.,Rivera, M.N.,Lawrence, M.S.,Bar-Peled, L.; DrugMap: A quantitative pan-cancer analysis of cysteine ligandability.; Cell, 187:2536-, 2024; PubMed: 38653237; DOI: 10.1016/j.cell.2024.03.027

Experimental method

X-RAY DIFFRACTION (2.02 Å)