8VXM

Human Bcl-2/Bcl-xL Chimera Fused to MBP in Complex with Inhibitor S55746

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Maltose/maltodextrin-binding periplasmic protein fused to apoptosis regulator Bcl-2/Bcl-xL chimera	polymer	547	61260.8	1	UniProt (P0AEX9) UniProt (P10415) UniProt (Q07817) Pfam (PF01547) Pfam (PF02180) Pfam (PF00452)	Escherichia coli K-12	Bcl2-L-1,Apoptosis regulator Bcl-X
2	B (A)	~{N}-(4-hydroxyphenyl)-3-[6-[[(3~{S})-3-(morpholin-4-ylmethyl)-3,4-dihydro-1~{H}-isoquinolin-2-yl]carbonyl]-1,3-benzodioxol-5-yl]-~{N}-phenyl-5,6,7,8-tetrahydroindolizine-1-carboxamide	non-polymer		710.8	1	Chemie (F3Q)
3	C (A)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	1	Chemie (PEG)
4	D (A)	water	water		18.0	68	Chemie (HOH)

Sequence modifications

A: -362 - 3 (UniProt: P0AEX9)

PDB	External Database	Details
Met -380	-	initiating methionine
His -379	-	expression tag
His -378	-	expression tag
His -377	-	expression tag
His -376	-	expression tag
His -375	-	expression tag
His -374	-	expression tag
His -373	-	expression tag
His -372	-	expression tag
His -371	-	expression tag
His -370	-	expression tag
Glu -369	-	expression tag
Asn -368	-	expression tag
Leu -367	-	expression tag
Tyr -366	-	expression tag
Phe -365	-	expression tag
Gln -364	-	expression tag
Gly -363	-	expression tag
Ala -281	Asp 108	engineered mutation
Ala -280	Lys 109	engineered mutation
Ala -191	Glu 198	engineered mutation
Ala -190	Asn 199	engineered mutation
Ala -124	Lys 265	engineered mutation
Ala 4	-	linker
Ala 5	-	linker
Arg 6	-	linker
Ala 7	-	linker
Ala 8	-	linker
Ala 9	-	linker

A: 10 - 34 (UniProt: P10415)
A: 92 - 207 (UniProt: P10415)
A: 76 - 91 (UniProt: Q07817)

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	61260.8
Non-Polymers*	Number of molecules	2
	Total formula weight	816.9
All*	Total formula weight	62077.8

*Water molecules are not included.