8EV2

Dual Modulators

Summary for 8EV2

Entry DOI	10.2210/pdb8ev2/pdb
Descriptor	Estrogen receptor, Nuclear receptor coactivator 2, (3~{a}~{R},4~{S},9~{b}~{S})-4-(2-chloranyl-4-oxidanyl-phenyl)-2,3,3~{a},4,5,9~{b}-hexahydro-1~{H}-cyclopenta[c]quinoline-8-sulfonamide, ... (5 entities in total)
Functional Keywords	er-alpha, ligand complex, carbonic anhydrase, dna binding protein
Biological source	Homo sapiens (human) More
Total number of polymer chains	4
Total formula weight	64789.79
Authors	Tinivella, A.,Nwachukwu, J.C.,Angeli, A.,Foschi, F.,Benatti, A.L.,Pinzi, L.,Izard, T.,Ferraroni, M.,Rangarajan, E.S.,Christodoulou, M.,Passarella, D.,Supuran, C.,Nettles, K.W.,Rastelli, G. (deposition date: 2022-10-19, release date: 2022-12-28, Last modification date: 2023-10-25)
Primary citation	Tinivella, A.,Nwachukwu, J.C.,Angeli, A.,Foschi, F.,Benatti, A.L.,Pinzi, L.,Izard, T.,Ferraroni, M.,Erumbi, R.,Christodoulou, M.S.,Passarella, D.,Supuran, C.T.,Nettles, K.W.,Rastelli, G. Design, synthesis, biological evaluation and crystal structure determination of dual modulators of carbonic anhydrases and estrogen receptors. Eur.J.Med.Chem., 246:115011-115011, 2022 Cited by PubMed: 36516582 DOI: 10.1016/j.ejmech.2022.115011 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.01 Å)

Structure validation