9VT5

Estrogen Receptor Alpha Ligand Binding Domain Y537S Mutant in Complex with Compound 4 and GRIP 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, B)	Estrogen receptor	polymer	267	30391.9	2	UniProt (P03372) Pfam (PF00104)	Homo sapiens (human)	ER,ER-alpha,Estradiol receptor,Nuclear receptor subfamily 3 group A member 1
2	C, D (A, B)	4-[(4-hydroxyphenyl)-[4-(4-thiophen-2-yl-2,1,3-benzothiadiazol-7-yl)phenyl]amino]phenol	non-polymer		493.6	2	Chemie (A1ETI)
3	E, F (A, B)	water	water		18.0	44	Chemie (HOH)

Sequence modifications

A, B: 1 - 258 (UniProt: P03372)

PDB	External Database	Details
Gly 0	-	expression tag
Ser 233	Tyr 537	engineered mutation
Ala 259	-	expression tag
Ile 260	-	expression tag
Leu 261	-	expression tag
His 262	-	expression tag
Arg 263	-	expression tag
Leu 264	-	expression tag
Leu 265	-	expression tag
Gln 266	-	expression tag
Ala 267	-	expression tag
Ile 268	-	expression tag
Leu 269	-	expression tag
His 270	-	expression tag
Arg 271	-	expression tag
Leu 272	-	expression tag
Leu 273	-	expression tag
Gln 274	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	60783.7
Non-Polymers*	Number of molecules	2
	Total formula weight	987.2
All*	Total formula weight	61770.9

*Water molecules are not included.