4WHF

Crystal Structure of TR3 LBD in complex with 1-(3,4,5-trihydroxyphenyl)decan-1-one

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	B, A	Nuclear receptor subfamily 4 group A member 1	polymer	257	28745.3	2	UniProt (P22736) Pfam (PF00104) In PDB	Homo sapiens (Human)	Early response protein NAK1,Nuclear hormone receptor NUR/77,Nur77,Orphan nuclear receptor HMR,Orphan nuclear receptor TR3,ST-59,Testicular receptor 3
2	B, A	GLYCEROL	non-polymer		92.1	5	Chemie (GOL)
3	A	1-(3,4,5-trihydroxyphenyl)decan-1-one	non-polymer		280.4	1	Chemie (3MX)
4		water	water		18.0	190	Chemie (HOH)

Sequence modifications

B, A: 20 - 267 (UniProt: P22736)

PDB	External Database	Details
Met 19	-	initiating methionine
Leu 268	-	expression tag
Glu 269	-	expression tag
His 270	-	expression tag
His 271	-	expression tag
His 272	-	expression tag
His 273	-	expression tag
His 274	-	expression tag
His 275	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	57490.6
Non-Polymers*	Number of molecules	6
	Total formula weight	740.8
All*	Total formula weight	58231.4

*Water molecules are not included.