8FMU

Crystal structure of human Brachyury G177D variant in complex with SJF-4601

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)	T-box transcription factor T	polymer	192	22080.4	2	UniProt (O15178) Pfam (PF00907)	Homo sapiens (human)	Brachyury protein,Protein T
2	C, D (A, B)	N-(3-chloro-4-fluorophenyl)-3-[4-(dimethylamino)butanamido]-4-methoxybenzamide	non-polymer		407.9	2	Chemie (Y3T)
3	E, F (A, B)	water	water		18.0	291	Chemie (HOH)

Sequence modifications

A, B: 41 - 224 (UniProt: O15178)

PDB	External Database	Details
Met 39	-	initiating methionine
Gly 40	-	expression tag
Asp 177	Gly 177	engineered mutation
His 225	-	expression tag
His 226	-	expression tag
His 227	-	expression tag
His 228	-	expression tag
His 229	-	expression tag
His 230	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	44160.8
Non-Polymers*	Number of molecules	2
	Total formula weight	815.7
All*	Total formula weight	44976.5

*Water molecules are not included.