7SHV

Crystal structure of BRAF kinase domain bound to GDC0879

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)	Serine/threonine-protein kinase B-raf	polymer	308	35330.8	2	UniProt (P15056) Pfam (PF07714)	Homo sapiens (Human)	Proto-oncogene B-Raf,p94,v-Raf murine sarcoma viral oncogene homolog B1
2	C, D (A, B)	2-{4-[(1E)-1-(hydroxyimino)-2,3-dihydro-1H-inden-5-yl]-3-(pyridin-4-yl)-1H-pyrazol-1-yl}ethanol	non-polymer		334.4	2	Chemie (29L)
3	E, F (B)	CHLORIDE ION	non-polymer		35.5	2	Chemie (CL)
4	G, H (A, B)	water	water		18.0	17	Chemie (HOH)

Sequence modifications

A, B: 432 - 726 (UniProt: P15056)

PDB	External Database	Details
Met 420	-	initiating methionine
Asp 421	-	expression tag
Arg 422	-	expression tag
Gly 423	-	expression tag
Ser 424	-	expression tag
His 425	-	expression tag
His 426	-	expression tag
His 427	-	expression tag
His 428	-	expression tag
His 429	-	expression tag
His 430	-	expression tag
Gly 431	-	expression tag
Leu 727	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	70661.6
Non-Polymers*	Number of molecules	4
	Total formula weight	739.7
All*	Total formula weight	71401.2

*Water molecules are not included.