8Q68

Crystal structure of TEAD1-YBD in complex with irreversible compound SWTX-143

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)	Transcriptional enhancer factor TEF-1	polymer	239	27609.4	2	UniProt (P28347) Pfam (PF17725)	Homo sapiens (human)
2	C, D (A, B)	~{N}-[(3~{S})-5-azanyl-1-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2~{H}-quinolin-3-yl]propanamide	non-polymer		363.4	2	Chemie (K46)
3	E, F (A, B)	water	water		18.0	285	Chemie (HOH)

Sequence modifications

A, B: 209 - 426 (UniProt: P28347)

PDB	External Database	Details
Met 188	-	initiating methionine
Gly 189	-	expression tag
Ser 190	-	expression tag
Ser 191	-	expression tag
His 192	-	expression tag
His 193	-	expression tag
His 194	-	expression tag
His 195	-	expression tag
His 196	-	expression tag
His 197	-	expression tag
Ser 198	-	expression tag
Ser 199	-	expression tag
Gly 200	-	expression tag
Leu 201	-	expression tag
Val 202	-	expression tag
Pro 203	-	expression tag
Arg 204	-	expression tag
Gly 205	-	expression tag
Ser 206	-	expression tag
His 207	-	expression tag
Met 208	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	55218.7
Non-Polymers*	Number of molecules	2
	Total formula weight	726.8
All*	Total formula weight	55945.5

*Water molecules are not included.