11SE

Covalent stabilizer compound 8 for the interaction between 14-3-3 sigma and Estrogen receptor-alpha peptide

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, C)	14-3-3 protein sigma	polymer	248	27807.1	2	UniProt (P31947) Pfam (PF00244)	Homo sapiens (human)	Epithelial cell marker protein 1,Stratifin
2	C, D (X, Y)	Estrogen receptor	polymer	15	1726.8	2	UniProt (P03372) Pfam (PF12743)	Homo sapiens (human)	ER,ER-alpha,Estradiol receptor,Nuclear receptor subfamily 3 group A member 1
3	E (A)	3-chloro-5-{[(1S)-1-methoxy-1-methyl-3-oxo-1,3-dihydro-2-benzofuran-4-yl]oxy}-4H-1,2,6-thiadiazin-4-one	non-polymer		340.7	1	Chemie (A1DAD)
4	F (C)	3-chloro-5-{[(1R)-1-methoxy-1-methyl-3-oxo-1,3-dihydro-2-benzofuran-4-yl]oxy}-4H-1,2,6-thiadiazin-4-one	non-polymer		340.7	1	Chemie (A1DAE)
5	G (C)	MAGNESIUM ION	non-polymer		24.3	1	Chemie (MG) PubChem (888)
6	H, I, J, K (A, C, X, Y)	water	water		18.0	171	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	59067.7
Non-Polymers*	Number of molecules	3
	Total formula weight	705.8
All*	Total formula weight	59773.5

*Water molecules are not included.