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7QBR

Human butyrylcholinesterase in complex with (Z)-N-tert-butyl-1-(8-(3-(4-(prop-2-yn-1-yl)piperazin-1-yl)propoxy)quinolin-2-yl)methanimine oxide

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1ACholinesterasepolymer52959713.51UniProt (P06276)
Pfam (PF00135)
In PDB
Homo sapiens (Human)Acylcholine acylhydrolase,Butyrylcholine esterase,Choline esterase II,Pseudocholinesterase
2B, D, E2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranosebranched570.53In PDB
GlyTouCan (G21290RB)
3Calpha-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranosebranched367.31In PDB
GlyTouCan (G86851RC)
4AGLYCEROLnon-polymer92.13Chemie (GOL)
5A2-acetamido-2-deoxy-beta-D-glucopyranosenon-polymer221.22Chemie (NAG)
6AN-tert-butyl-1-[8-[3-(4-prop-2-ynylpiperazin-1-yl)propoxy]quinolin-2-yl]methanimine oxidenon-polymer408.51Chemie (AI6)
7AN-acetyl-alpha-neuraminic acidnon-polymer309.31Chemie (SIA)
8A2-(N-MORPHOLINO)-ETHANESULFONIC ACIDnon-polymer195.21Chemie (MES)
9ACHLORIDE IONnon-polymer35.54Chemie (CL)
10ASULFATE IONnon-polymer96.14Chemie (SO4)
11waterwater18.0214Chemie (HOH)
Sequence modifications
A: 1 - 529 (UniProt: P06276)
PDBExternal DatabaseDetails
Gln 17Asn 45engineered mutation
Gln 455Asn 483engineered mutation
Gln 481Asn 509engineered mutation
Gln 486Asn 514engineered mutation
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains1
Total formula weight59713.5
BranchedNumber of molecules4
Total formula weight2079.0
Non-Polymers*Number of molecules16
Total formula weight2157.8
All*Total formula weight63950.3
*Water molecules are not included.

221051

PDB entries from 2024-06-12

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