4TPK

Human butyrylcholinesterase in complex with N-((1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl)methyl)-N-(2-methoxyethyl)-2-naphthamide

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)	Cholinesterase	polymer	602	68488.7	2	UniProt (P06276) Pfam (PF00135) Pfam (PF08674)	Homo sapiens (Human)	Acylcholine acylhydrolase,Butyrylcholine esterase,Choline esterase II,Pseudocholinesterase
2	C, J (C, J)	beta-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		367.3	2	In PDB GlyTouCan (G61843VN)
3	D, G, H, I (D, G, H, I)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	4	In PDB GlyTouCan (G42666HT)
4	E (E)	alpha-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		367.3	1	In PDB GlyTouCan (G86851RC)
5	F (F)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose	branched		570.5	1	In PDB GlyTouCan (G21290RB)
6	K, P, Q, R, S... (A, B)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	7	Chemie (NAG)
7	L, V (A, B)	N-{[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]methyl}-N-(2-methoxyethyl)naphthalene-2-carboxamide	non-polymer		442.6	2	Chemie (3F9)
8	M, W, X, Y, Z (A, B)	GLYCEROL	non-polymer		92.1	5	Chemie (GOL)
9	AA, N, O (B, A)	1,2-ETHANEDIOL	non-polymer		62.1	3	Chemie (EDO)
10	BA, CA (A, B)	water	water		18.0	172	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	136977.5
Branched	Number of molecules	8
	Total formula weight	3370.2
Non-Polymers*	Number of molecules	17
	Total formula weight	3080.3
All*	Total formula weight	143428.0

*Water molecules are not included.