4BQU

Japanin from Rhipicephalus appendiculatus bound to cholesterol: Orthorhombic crystal form

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)	JAPANIN	polymer	160	18640.1	2	UniProt (M1MR49)	RHIPICEPHALUS APPENDICULATUS
2	C (C)	alpha-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose	branched		732.7	1	In PDB GlyTouCan (G47477HI)
3	D, E (D, E)	alpha-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		367.3	2	In PDB GlyTouCan (G86851RC)
4	F, M (A, B)	CHOLESTEROL	non-polymer		386.7	2	Chemie (CLR)
5	G, H, I, N, O... (A, B)	1,2-ETHANEDIOL	non-polymer		62.1	7	Chemie (EDO)
6	J (A)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	1	Chemie (NAG)
7	K, L, R (A, B)	CHLORIDE ION	non-polymer		35.5	3	Chemie (CL)
8	S, T (A, B)	water	water		18.0	77	Chemie (HOH)

Sequence modifications

A, B: 1 - 152 (UniProt: M1MR49)

PDB	External Database	Details
Gly 153	-	expression tag
Gly 154	-	expression tag
His 155	-	expression tag
His 156	-	expression tag
His 157	-	expression tag
His 158	-	expression tag
His 159	-	expression tag
His 160	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	37280.2
Branched	Number of molecules	3
	Total formula weight	1467.4
Non-Polymers*	Number of molecules	13
	Total formula weight	1535.4
All*	Total formula weight	40282.9

*Water molecules are not included.