5JQ7

Crystal structure of Ebola glycoprotein in complex with toremifene

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Envelope glycoprotein 1,Envelope glycoprotein 1,Envelope glycoprotein 1	polymer	330	36302.7	1	UniProt (Q05320) Pfam (PF01611) In PDB	Ebola virus - Mayinga Zaire 1976	GP1,2,GP,GP1,2,GP,GP1,2,GP
2	B	Envelope glycoprotein 2	polymer	168	18989.4	1	UniProt (Q05320) In PDB	Ebola virus - Mayinga Zaire 1976	GP1,2,GP
3	C	alpha-D-mannopyranose-(1-6)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		748.7	1	In PDB GlyTouCan (G22573RC)
4	A	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	4	Chemie (NAG)
5	A	GLYCEROL	non-polymer		92.1	2	Chemie (GOL)
6	A	DIMETHYL SULFOXIDE	non-polymer		78.1	1	Chemie (DMS)
7	B	Toremifene	non-polymer		406.0	1	Chemie (T0R)
8		water	water		18.0	53	Chemie (HOH)

Sequence modifications

A: 32 - 432 (UniProt: Q05320)

PDB	External Database	Details
Glu 28	-	expression tag
Thr 29	-	expression tag
Gly 30	-	expression tag
Arg 31	-	expression tag
Ala 42	Thr 42	engineered mutation

A: 433 - 470 (UniProt: Q05320)
A: 471 - 477 (PDB: 5JQ7)
B: 502 - 632 (UniProt: Q05320)

PDB	External Database	Details
Gly 633	-	expression tag
Ser 634	-	expression tag
Gly 635	-	expression tag
Tyr 636	-	expression tag
Ile 637	-	expression tag
Pro 638	-	expression tag
Glu 639	-	expression tag
Ala 640	-	expression tag
Pro 641	-	expression tag
Arg 642	-	expression tag
Asp 643	-	expression tag
Gly 644	-	expression tag
Gln 645	-	expression tag
Ala 646	-	expression tag
Tyr 647	-	expression tag
Val 648	-	expression tag
Arg 649	-	expression tag
Lys 650	-	expression tag
Asp 651	-	expression tag
Gly 652	-	expression tag
Glu 653	-	expression tag
Trp 654	-	expression tag
Val 655	-	expression tag
Leu 656	-	expression tag
Leu 657	-	expression tag
Ser 658	-	expression tag
Thr 659	-	expression tag
Phe 660	-	expression tag
Leu 661	-	expression tag
Gly 662	-	expression tag
Thr 663	-	expression tag
His 664	-	expression tag
His 665	-	expression tag
His 666	-	expression tag
His 667	-	expression tag
His 668	-	expression tag
His 669	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	55292.1
Branched	Number of molecules	1
	Total formula weight	748.7
Non-Polymers*	Number of molecules	8
	Total formula weight	1553.1
All*	Total formula weight	57593.9

*Water molecules are not included.