13DU

BRAF/CRAF/14-3-3 complex

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Serine/threonine-protein kinase B-raf	polymer	354	40261.1	1	UniProt (P15056)	Homo sapiens (human)	Proto-oncogene B-Raf,p94,v-Raf murine sarcoma viral oncogene homolog B1
2	B (B)	RAF proto-oncogene serine/threonine-protein kinase	polymer	367	41662.3	1	UniProt (P04049)	Homo sapiens (human)	Proto-oncogene c-RAF,cRaf,Raf-1
3	C (X)	14-3-3 protein epsilon	polymer	262	29752.2	1	UniProt (A0A2H1VA22)	Spodoptera frugiperda (fall armyworm)
4	D (Y)	14-3-3 protein zeta	polymer	247	28108.5	1	UniProt (A0A9R0D7T1)	Spodoptera frugiperda (fall armyworm)
5	E, F (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) PubChem (11717001)

Sequence modifications

A: 435 - 766 (UniProt: P15056)

PDB	External Database	Details
Met 413	-	initiating methionine
Asp 414	-	expression tag
Trp 415	-	expression tag
Ser 416	-	expression tag
His 417	-	expression tag
Pro 418	-	expression tag
Gln 419	-	expression tag
Phe 420	-	expression tag
Glu 421	-	expression tag
Lys 422	-	expression tag
Ser 423	-	expression tag
Ala 424	-	expression tag
Val 425	-	expression tag
Asp 426	-	expression tag
Glu 427	-	expression tag
Asn 428	-	expression tag
Leu 429	-	expression tag
Tyr 430	-	expression tag
Phe 431	-	expression tag
Gln 432	-	expression tag
Gly 433	-	expression tag
Gly 434	-	expression tag

B: 306 - 648 (UniProt: P04049)

PDB	External Database	Details
Met 282	-	initiating methionine
Gly 283	-	expression tag
Ser 284	-	expression tag
Ser 285	-	expression tag
His 286	-	expression tag
His 287	-	expression tag
His 288	-	expression tag
His 289	-	expression tag
His 290	-	expression tag
His 291	-	expression tag
Ser 292	-	expression tag
Ala 293	-	expression tag
Val 294	-	expression tag
Asp 295	-	expression tag
Glu 296	-	expression tag
Asn 297	-	expression tag
Leu 298	-	expression tag
Tyr 299	-	expression tag
Phe 300	-	expression tag
Gln 301	-	expression tag
Gly 302	-	expression tag
Gly 303	-	expression tag
Gly 304	-	expression tag
Arg 305	-	expression tag
Asp 340	Tyr 340	engineered mutation
Asp 341	Tyr 341	engineered mutation
Glu 559	Phe 559	engineered mutation
Ala 563	Arg 563	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	139784.1
Non-Polymers*	Number of molecules	2
	Total formula weight	668.7
All*	Total formula weight	140452.8

*Water molecules are not included.