DB code: S00057
| RLCP classification | 1.12.30000.14 : Hydrolysis | |
|---|---|---|
| CATH domain | 3.40.50.1820 : Rossmann fold | Catalytic domain |
| E.C. | 3.1.1.7 | |
| CSA | 2ace | |
| M-CSA | 2ace | |
| MACiE | ||
| CATH domain | Related DB codes (homologues) |
|---|---|
| 3.40.50.1820 : Rossmann fold | S00544 S00344 S00517 S00525 S00526 S00720 S00723 S00724 S00725 S00919 S00374 S00345 S00347 S00348 S00346 S00350 S00352 S00353 S00355 S00356 S00358 D00189 D00210 D00539 T00253 |
| Uniprot Enzyme Name | UniprotKB | Protein name | Synonyms | MEROPS | Pfam | RefSeq |
|---|---|---|---|---|---|
| P04058 |
Acetylcholinesterase
|
AChE
EC 3.1.1.7 |
S09.979
(Serine)
|
PF00135
(COesterase)
[Graphical View] |
|
| P22303 |
Acetylcholinesterase
|
AChE
EC 3.1.1.7 |
S09.979
(Serine)
|
PF08674
(AChE_tetra)
PF00135 (COesterase) [Graphical View] |
NP_000656.1
(Protein)
NM_000665.3 (DNA/RNA sequence) NP_056646.1 (Protein) NM_015831.2 (DNA/RNA sequence) |
| KEGG enzyme name |
|---|
|
acetylcholinesterase
true cholinesterase choline esterase I cholinesterase acetylthiocholinesterase acetylcholine hydrolase acetyl.beta-methylcholinesterase AcCholE |
| UniprotKB: Accession Number | Entry name | Activity | Subunit | Subcellular location | Cofactor |
|---|---|---|---|---|---|
| P04058 | ACES_TORCA | Acetylcholine + H(2)O = choline + acetate. | Isoform H form is an homodimer, the asymmetric form is a disulfide-bonded oligomer composed of a collagenic subunit (Q) and a variable number of T catalytic subunits. | Isoform H: Cell membrane, Lipid-anchor, GPI- anchor. Cell junction, synapse. Isoform T: Cell membrane, Peripheral membrane protein. Cell junction, synapse. Note=Attached to the membrane through disulfide linkage with the collagenic subunit, itself bound to the membrane. | |
| P22303 | ACES_HUMAN | Acetylcholine + H(2)O = choline + acetate. | Interacts with PRIMA1. The interaction with PRIMA1 is required to anchor it to the basal lamina of cells and organize into tetramers (By similarity). Isoform H generates GPI-anchored dimers, disulfide linked. Isoform T generates multiple structures, ranging from monomers and dimers to collagen-tailed and hydrophobic-tailed forms, in which catalytic tetramers are associated with anchoring proteins that attach them to the basal lamina or to cell membranes. In the collagen-tailed forms, isoform T subunits are associated with a specific collagen, COLQ, which triggers the formation of isoform T tetramers, from monomers and dimers. Isoform R may be monomeric. | Cell junction, synapse. Secreted (By similarity). Cell membrane, Peripheral membrane protein (By similarity). Isoform T: Nucleus. Note=Only observed in apoptotic nuclei. Isoform H: Cell membrane, Lipid-anchor, GPI- anchor, Extracellular side (By similarity). |
| KEGG Pathways | Map code | Pathways | E.C. |
|---|---|---|
| MAP00564 | Glycerophospholipid metabolism |
| Compound table | ||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Substrates | Products | Intermediates | ||||||||||
| KEGG-id | C01996 | C00001 | C00114 | C00033 | I00124 | I00125 | I00126 | |||||
| E.C. | ||||||||||||
| Compound | Acetylcholine | H2O | Choline | Acetate | Peptidyl-Ser-tetrahedral intermediate (with previous acetylcholine carboxylic-ester) | Acetyl-enzyme (Peptidyl-Ser-acetyl group) | Peptidyl-Ser-acetyl-tetrahedral-intermediate | |||||
| Type | amine group,carbohydrate | H2O | amine group,carbohydrate | carboxyl group | ||||||||
| ChEBI |
15355 15355 |
15377 15377 |
15354 15354 |
15366 15366 |
||||||||
| PubChem |
187 187 |
22247451 962 22247451 962 |
305 305 |
176 21980959 176 21980959 |
||||||||
| 1acjA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1aclA |
|
|
|
|
|
Analogue:DME | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1amnA |
|
|
|
|
|
Unbound | Unbound | Unbound | Transition-state-analogue:NAF | Unbound | Unbound | |
| 1ax9A |
|
|
|
|
|
Unbound | Analogue:EDR | Unbound | Unbound | Unbound | Unbound | |
| 1cfjA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Transition-state-analogue:_GB | |
| 1dx6A |
|
|
|
|
|
Unbound | Analogue:GNT | Unbound | Unbound | Unbound | Unbound | |
| 1e3qA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1e66A |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1ea5A |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1eeaA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1eveA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1fssA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1gpkA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1gpnA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1gqrA |
|
|
|
|
|
Unbound | Analogue:SAF | Unbound | Unbound | Intermediate-analogue:EMM | Unbound | |
| 1gqsA |
|
|
|
|
|
Unbound | Analogue:SAF | Unbound | Unbound | Unbound | Unbound | |
| 1h22A |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1h23A |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1hbjA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Transition-state-analogue:FBQ | |
| 1jjbA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1oceA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Intermediate-analogue:MF2 | Unbound | |
| 1qidA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qieA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qifA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qigA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qihA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qiiA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qijA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qikA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qimA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1qtiA |
|
|
|
|
|
Unbound | Analogue:GNT | Unbound | Unbound | Unbound | Unbound | |
| 1somA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Transition-state-analogue:VXA | |
| 1votA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1vxoA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Transition-state-analogue:VXA | |
| 1vxrA |
|
|
|
|
|
Unbound | Unbound | Unbound | Transition-state-analogue:_VX | Unbound | Unbound | |
| 1w4lA |
|
|
|
|
|
Unbound | Analogue:GL8 | Unbound | Unbound | Unbound | Unbound | |
| 1w6rA |
|
|
|
|
|
Unbound | Analogue:GNT | Unbound | Unbound | Unbound | Unbound | |
| 1w75A |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1w75B |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1w76A |
|
|
|
|
|
Unbound | Analogue:GNT | Unbound | Unbound | Unbound | Unbound | |
| 1w76B |
|
|
|
|
|
Unbound | Analogue:GNT | Unbound | Unbound | Unbound | Unbound | |
| 2aceA |
|
|
|
|
|
Unbound | Unbound | Unbound | Transition-state-bound:ACH | Unbound | Unbound | |
| 2ackA |
|
|
|
|
|
Unbound | Analogue:EDR | Unbound | Unbound | Unbound | Unbound | |
| 2dfpA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Transition-state-analogue:MIS | |
| 1b41A |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| 1f8uA |
|
|
|
|
|
Unbound | Unbound | Unbound | Unbound | Unbound | Unbound | |
| Reference for Active-site residues | ||
|---|---|---|
| resource | references | E.C. |
| PDB;1acj & Swiss-prot;P22303, P04058 | ||
| Active-site residues | ||||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| PDB | Catalytic residues | Cofactor-binding residues | Modified residues | Main-chain involved in catalysis | Comment | |||||
| 1acjA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1aclA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1amnA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1ax9A |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1cfjA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1dx6A |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1e3qA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1e66A |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1ea5A |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1eeaA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1eveA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1fssA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1gpkA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1gpnA |
|
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|
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|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1gqrA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1gqsA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1h22A |
|
|
|
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|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1h23A |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1hbjA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1jjbA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1oceA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qidA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qieA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qifA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qigA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qihA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qiiA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qijA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qikA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qimA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1qtiA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1somA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1votA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1vxoA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1vxrA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1w4lA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1w6rA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1w75A |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1w75B |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1w76A |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 1w76B |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 2aceA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 2ackA |
|
|
|
|
|
SER 200;GLU 327;HIS 440 | GLY 118;GLY 119;ALA 201 | |||
| 2dfpA |
|
|
|
|
|
;GLU 327;HIS 440 | MIS 200 | GLY 118;GLY 119;ALA 201 | Modified Ser200 | |
| 1b41A |
|
|
|
|
|
SER 203;GLU 334;HIS 447 | GLY 121;GLY 122;ALA 204 | |||
| 1f8uA |
|
|
|
|
|
SER 203;GLU 334;HIS 447 | GLY 121;GLY 122;ALA 204 | |||
| References for Catalytic Mechanism | ||
|---|---|---|
| References | Sections | No. of steps in catalysis |
|
[1]
|
p.876-877 | |
|
[8]
|
Scheme 1 | |
|
[20]
|
p.838-839 | |
|
[24]
|
p.2324-2326 | |
|
[36]
|
Scheme 1 | |
|
[52]
|
Scheme 1, p.5683 | |
|
[53]
|
Fig.3 | |
| References | |
|---|---|
| [1] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (2.8 ANGSTROMS). |
| Medline ID | 91343928 |
| PubMed ID | 1678899 |
| Journal | Science |
| Year | 1991 |
| Volume | 253 |
| Pages | 872-9 |
| Authors | Sussman JL, Harel M, Frolow F, Oefner C, Goldman A, Toker L, Silman I |
| Title | Atomic structure of acetylcholinesterase from Torpedo californica: a prototypic acetylcholine-binding protein. |
| Related PDB | |
| Related UniProtKB | P04058 |
| [2] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 1396557 |
| Journal | EMBO J |
| Year | 1992 |
| Volume | 11 |
| Pages | 3561-8 |
| Authors | Shafferman A, Velan B, Ordentlich A, Kronman C, Grosfeld H, Leitner M, Flashner Y, Cohen S, Barak D, Ariel N |
| Title | Substrate inhibition of acetylcholinesterase: residues affecting signal transduction from the surface to the catalytic center. |
| Related PDB | |
| Related UniProtKB | |
| [3] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 1429564 |
| Journal | J Biol Chem |
| Year | 1992 |
| Volume | 267 |
| Pages | 22122-30 |
| Authors | le Du MH, Marchot P, Bougis PE, Fontecilla-Camps JC |
| Title |
1.9-A resolution structure of fasciculin 1, |
| Related PDB | |
| Related UniProtKB | |
| [4] | |
| Resource | |
| Comments | MUTAGENESIS OF ACTIVE SITE RESIDUES AND OF ASP-206 AND ASP-435. |
| Medline ID | 92388112 |
| PubMed ID | 1517212 |
| Journal | J Biol Chem |
| Year | 1992 |
| Volume | 267 |
| Pages | 17640-8 |
| Authors | Shafferman A, Kronman C, Flashner Y, Leitner M, Grosfeld H, Ordentlich A, Gozes Y, Cohen S, Ariel N, Barak D, et al |
| Title |
Mutagenesis of human acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | P22303 |
| [5] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 1412713 |
| Journal | Trends Biochem Sci |
| Year | 1992 |
| Volume | 17 |
| Pages | 353-8 |
| Authors | Soreq H, Gnatt A, Loewenstein Y, Neville LF |
| Title | Excavations into the active-site gorge of cholinesterases. |
| Related PDB | |
| Related UniProtKB | |
| [6] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8343975 |
| Journal | Chem Biol Interact |
| Year | 1993 |
| Volume | 87 |
| Pages | 187-97 |
| Authors | Sussman JL, Harel M, Silman I |
| Title | Three-dimensional structure of acetylcholinesterase and of its complexes with anticholinesterase drugs. |
| Related PDB | |
| Related UniProtKB | |
| [7] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8224249 |
| Journal | FEBS Lett |
| Year | 1993 |
| Volume | 334 |
| Pages | 215-20 |
| Authors | Ordentlich A, Kronman C, Barak D, Stein D, Ariel N, Marcus D, Velan B, Shafferman A |
| Title |
Engineering resistance to 'aging' of phosphylated human acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [8] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8262242 |
| Journal | FEBS Lett |
| Year | 1993 |
| Volume | 336 |
| Pages | 263-6 |
| Authors | Qian N, Kovach IM |
| Title | Key active site residues in the inhibition of acetylcholinesterases by soman. |
| Related PDB | |
| Related UniProtKB | |
| [9] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 8415649 |
| Journal | Proc Natl Acad Sci U S A |
| Year | 1993 |
| Volume | 90 |
| Pages | 9031-5 |
| Authors | Harel M, Schalk I, Ehret-Sabatier L, Bouet F, Goeldner M, Hirth C, Axelsen PH, Silman I, Sussman JL |
| Title | Quaternary ligand binding to aromatic residues in the active-site gorge of acetylcholinesterase. |
| Related PDB | 1acj 1acl |
| Related UniProtKB | |
| [10] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 7821677 |
| Journal | Biochem Soc Trans |
| Year | 1994 |
| Volume | 22 |
| Pages | 745-9 |
| Authors | Silman I, Harel M, Axelsen P, Raves M, Sussman JL |
| Title | Three-dimensional structures of acetylcholinesterase and of its complexes with anticholinesterase agents. |
| Related PDB | |
| Related UniProtKB | |
| [11] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8031791 |
| Journal | Biochemistry |
| Year | 1994 |
| Volume | 33 |
| Pages | 8566-76 |
| Authors | Nair HK, Seravalli J, Arbuckle T, Quinn DM |
| Title | Molecular recognition in acetylcholinesterase catalysis: free-energy correlations for substrate turnover and inhibition by trifluoro ketone transition-state analogs. |
| Related PDB | |
| Related UniProtKB | |
| [12] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8003956 |
| Journal | Protein Sci |
| Year | 1994 |
| Volume | 3 |
| Pages | 188-97 |
| Authors | Axelsen PH, Harel M, Silman I, Sussman JL |
| Title | Structure and dynamics of the active site gorge of acetylcholinesterase: synergistic use of molecular dynamics simulation and X-ray crystallography. |
| Related PDB | |
| Related UniProtKB | |
| [13] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8122110 |
| Journal | Science |
| Year | 1994 |
| Volume | 263 |
| Pages | 1276-8 |
| Authors | Gilson MK, Straatsma TP, McCammon JA, Ripoll DR, Faerman CH, Axelsen PH, Silman I, Sussman JL |
| Title | Open "back door" in a molecular dynamics simulation of acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [14] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 7492545 |
| Journal | Biochemistry |
| Year | 1995 |
| Volume | 34 |
| Pages | 15444-52 |
| Authors | Barak D, Ordentlich A, Bromberg A, Kronman C, Marcus D, Lazar A, Ariel N, Velan B, Shafferman A |
| Title | Allosteric modulation of acetylcholinesterase activity by peripheral ligands involves a conformational transition of the anionic subsite. |
| Related PDB | |
| Related UniProtKB | |
| [15] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8521480 |
| Journal | Cell |
| Year | 1995 |
| Volume | 83 |
| Pages | 503-12 |
| Authors | Bourne Y, Taylor P, Marchot P |
| Title | Acetylcholinesterase inhibition by fasciculin: crystal structure of the complex. |
| Related PDB | |
| Related UniProtKB | |
| [16] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 7836436 |
| Journal | J Biol Chem |
| Year | 1995 |
| Volume | 270 |
| Pages | 2082-91 |
| Authors | Ordentlich A, Barak D, Kronman C, Ariel N, Segall Y, Velan B, Shafferman A |
| Title | Contribution of aromatic moieties of tyrosine 133 and of the anionic subsite tryptophan 86 to catalytic efficiency and allosteric modulation of acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [17] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 7657613 |
| Journal | J Biol Chem |
| Year | 1995 |
| Volume | 270 |
| Pages | 20391-9 |
| Authors | Radic Z, Quinn DM, Vellom DC, Camp S, Taylor P |
| Title | Allosteric control of acetylcholinesterase catalysis by fasciculin. |
| Related PDB | |
| Related UniProtKB | |
| [18] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 7613468 |
| Journal | Protein Sci |
| Year | 1995 |
| Volume | 4 |
| Pages | 703-15 |
| Authors | van den Born HK, Radic Z, Marchot P, Taylor P, Tsigelny I |
| Title | Theoretical analysis of the structure of the peptide fasciculin and its docking to acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [19] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (3.0 ANGSTROMS) OF COMPLEX WITH FASCICULIN. |
| Medline ID | 96363673 |
| PubMed ID | 8747462 |
| Journal | Structure |
| Year | 1995 |
| Volume | 3 |
| Pages | 1355-66 |
| Authors | Harel M, Kleywegt GJ, Ravelli RB, Silman I, Sussman JL |
| Title | Crystal structure of an acetylcholinesterase-fasciculin complex: interaction of a three-fingered toxin from snake venom with its target. |
| Related PDB | 1fss |
| Related UniProtKB | P04058 |
| [20] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8836126 |
| Journal | Biochem J |
| Year | 1996 |
| Volume | 318 |
| Pages | 833-40 |
| Authors | Shafferman A, Ordentlich A, Barak D, Stein D, Ariel N, Velan B |
| Title | Aging of phosphylated human acetylcholinesterase: catalytic processes mediated by aromatic and polar residues of the active centre. |
| Related PDB | |
| Related UniProtKB | |
| [21] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8718893 |
| Journal | Biochemistry |
| Year | 1996 |
| Volume | 35 |
| Pages | 10995-1004 |
| Authors | Hosea NA, Radic Z, Tsigelny I, Berman HA, Quinn DM, Taylor P |
| Title | Aspartate 74 as a primary determinant in acetylcholinesterase governing specificity to cationic organophosphonates. |
| Related PDB | |
| Related UniProtKB | |
| [22] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8635606 |
| Journal | FEBS Lett |
| Year | 1996 |
| Volume | 386 |
| Pages | 65-71 |
| Authors | Faerman C, Ripoll D, Bon S, Le Feuvre Y, Morel N, Massoulie J, Sussman JL, Silman I |
| Title | Site-directed mutants designed to test back-door hypotheses of acetylcholinesterase function. |
| Related PDB | |
| Related UniProtKB | |
| [23] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8849682 |
| Journal | FEBS Lett |
| Year | 1996 |
| Volume | 395 |
| Pages | 22-8 |
| Authors | Velan B, Barak D, Ariel N, Leitner M, Bino T, Ordentlich A, Shafferman A |
| Title | Structural modifications of the omega loop in human acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [24] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | |
| Journal | J Am Chem Soc |
| Year | 1996 |
| Volume | 118 |
| Pages | 2340-6 |
| Authors | Harel M, Quinn DM, Nair HK, Silman I, Sussman JL |
| Title | The X-ray structure of a transition state analog complex reveals the molecular origins of the catalytic power and substrate specificity of acetylcholinesterase. |
| Related PDB | 1amn |
| Related UniProtKB | |
| [25] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 8845756 |
| Journal | Protein Sci |
| Year | 1996 |
| Volume | 5 |
| Pages | 672-9 |
| Authors | Marchot P, Ravelli RB, Raves ML, Bourne Y, Vellom DC, Kanter J, Camp S, Sussman JL, Taylor P |
| Title |
Soluble monomeric acetylcholinesterase from mouse: expression, |
| Related PDB | |
| Related UniProtKB | |
| [26] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 9202137 |
| Journal | FEBS Lett |
| Year | 1997 |
| Volume | 409 |
| Pages | 155-60 |
| Authors | Pomponi M, Marta M, Colella A, Sacchi S, Patamia M, Gatta F, Capone F, Oliverio A, Pavone F |
| Title | Studies on a new series of THA analogues: effects of the aromatic residues that line the gorge of AChE. |
| Related PDB | |
| Related UniProtKB | |
| [27] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (2.5 ANGSTROMS). |
| Medline ID | 97143314 |
| PubMed ID | 8989325 |
| Journal | Nat Struct Biol |
| Year | 1997 |
| Volume | 4 |
| Pages | 57-63 |
| Authors | Raves ML, Harel M, Pang YP, Silman I, Kozikowski AP, Sussman JL |
| Title |
Structure of acetylcholinesterase complexed with the nootropic alkaloid, |
| Related PDB | 1vot 2ace |
| Related UniProtKB | P04058 |
| [28] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 9261870 |
| Journal | Proteins |
| Year | 1997 |
| Volume | 28 |
| Pages | 543-55 |
| Authors | Albaret C, Lacoutiere S, Ashman WP, Froment D, Fortier PL |
| Title | Molecular mechanic study of nerve agent O-ethyl S-[2-(diisopropylamino)ethyl]methylphosphonothioate (VX) bound to the active site of Torpedo californica acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [29] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 10089512 |
| Journal | Acta Crystallogr D Biol Crystallogr |
| Year | 1998 |
| Volume | 54 |
| Pages | 1359-66 |
| Authors | Ravelli RB, Raves ML, Ren Z, Bourgeois D, Roth M, Kroon J, Silman I, Sussman JL |
| Title | Static Laue diffraction studies on acetylcholinesterase. |
| Related PDB | 1ax9 |
| Related UniProtKB | |
| [30] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 9742217 |
| Journal | Biochem J |
| Year | 1998 |
| Volume | 335 |
| Pages | 95-102 |
| Authors | Ariel N, Ordentlich A, Barak D, Bino T, Velan B, Shafferman A |
| Title | The 'aromatic patch' of three proximal residues in the human acetylcholinesterase active centre allows for versatile interaction modes with inhibitors. |
| Related PDB | |
| Related UniProtKB | |
| [31] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 9691268 |
| Journal | Biophys Chem |
| Year | 1998 |
| Volume | 72 |
| Pages | 239-46 |
| Authors | Pomponi M, Sacchi S, Colella A, Patamia M, Marta M |
| Title | The role of TRP84 in catalytic power and the specificity of AChE. |
| Related PDB | |
| Related UniProtKB | |
| [32] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 9789806 |
| Journal | J Physiol Paris |
| Year | 1998 |
| Volume | 92 |
| Pages | 191-4 |
| Authors | Kryger G, Silman I, Sussman JL |
| Title | Three-dimensional structure of a complex of E2020 with acetylcholinesterase from Torpedo californica. |
| Related PDB | |
| Related UniProtKB | |
| [33] | |
| Resource | |
| Comments | X-ray crystallography (ISBN: 0306460505) |
| Medline ID | |
| PubMed ID | |
| Journal | Structure and Function of Cholinesterases and Related Proteins |
| Year | 1998 |
| Volume | |
| Pages | |
| Authors | Raves ML, Giles K, Schrag JD, Schmid MF, Phillips GN, Wah C, Howard AJ, Silman I, Sussman JL |
| Title | Quaternary structure of tetrameric acetylcholinesterase. |
| Related PDB | 1eea |
| Related UniProtKB | |
| [34] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (2.7 ANGSTROMS). |
| Medline ID | 99249780 |
| PubMed ID | 10231521 |
| Journal | Biochemistry |
| Year | 1999 |
| Volume | 38 |
| Pages | 5714-9 |
| Authors | Bartolucci C, Perola E, Cellai L, Brufani M, Lamba D |
| Title | "Back door" opening implied by the crystal structure of a carbamoylated acetylcholinesterase. |
| Related PDB | 1oce |
| Related UniProtKB | P04058 |
| [35] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 10433700 |
| Journal | Biochemistry |
| Year | 1999 |
| Volume | 38 |
| Pages | 9937-47 |
| Authors | Luo C, Saxena A, Smith M, Garcia G, Radic Z, Taylor P, Doctor BP |
| Title | Phosphoryl oxime inhibition of acetylcholinesterase during oxime reactivation is prevented by edrophonium. |
| Related PDB | |
| Related UniProtKB | |
| [36] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (2.3 ANGSTROMS). |
| Medline ID | 99282167 |
| PubMed ID | 10353814 |
| Journal | Biochemistry |
| Year | 1999 |
| Volume | 38 |
| Pages | 7032-9 |
| Authors | Millard CB, Kryger G, Ordentlich A, Greenblatt HM, Harel M, Raves ML, Segall Y, Barak D, Shafferman A, Silman I, Sussman JL |
| Title | Crystal structures of aged phosphonylated acetylcholinesterase: nerve agent reaction products at the atomic level. |
| Related PDB | 1cfj 1som 2dfp |
| Related UniProtKB | P04058 |
| [37] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (2.3 ANGSTROMS). |
| Medline ID | 20074924 |
| PubMed ID | 10606746 |
| Journal | FEBS Lett |
| Year | 1999 |
| Volume | 463 |
| Pages | 321-6 |
| Authors | Greenblatt HM, Kryger G, Lewis T, Silman I, Sussman JL |
| Title | Structure of acetylcholinesterase complexed with (-)-galanthamine at 2.3 A resolution. |
| Related PDB | 1dx6 |
| Related UniProtKB | P04058 |
| [38] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | |
| Journal | J Am Chem Soc |
| Year | 1999 |
| Volume | 121 |
| Pages | 9883-4 |
| Authors | Millard CB, Koellner G, Ordentlich A, Shafferman A, Silman I, Sussman JL |
| Title | Reaction products of acetylcholinesterase and VX reveal a mobile histidine in the catalytic triad. |
| Related PDB | 1vxo 1vxr |
| Related UniProtKB | |
| [39] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 10521413 |
| Journal | J Biol Chem |
| Year | 1999 |
| Volume | 274 |
| Pages | 30370-6 |
| Authors | Bourne Y, Grassi J, Bougis PE, Marchot P |
| Title | Conformational flexibility of the acetylcholinesterase tetramer suggested by x-ray crystallography. |
| Related PDB | |
| Related UniProtKB | P04058 |
| [40] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 9915834 |
| Journal | J Biol Chem |
| Year | 1999 |
| Volume | 274 |
| Pages | 2963-70 |
| Authors | Bourne Y, Taylor P, Bougis PE, Marchot P |
| Title |
Crystal structure of mouse acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [41] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 10602696 |
| Journal | J Med Chem |
| Year | 1999 |
| Volume | 42 |
| Pages | 5110-9 |
| Authors | Barril X, Orozco M, Luque FJ |
| Title | Predicting relative binding free energies of tacrine-huperzine A hybrids as inhibitors of acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [42] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (2.5 ANGSTROMS). |
| Medline ID | 99197295 |
| PubMed ID | 10368299 |
| Journal | Structure Fold Des |
| Year | 1999 |
| Volume | 7 |
| Pages | 297-307 |
| Authors | Kryger G, Silman I, Sussman JL |
| Title | Structure of acetylcholinesterase complexed with E2020 (Aricept): implications for the design of new anti-Alzheimer drugs. |
| Related PDB | 1eve |
| Related UniProtKB | P04058 |
| [43] | |
| Resource | |
| Comments | X-RAY CRYSTALLOGRAPHY (2.9 ANGSTROMS) OF 36-574. |
| Medline ID | 20508217 |
| PubMed ID | 11053835 |
| Journal | Acta Crystallogr D Biol Crystallogr |
| Year | 2000 |
| Volume | 56 |
| Pages | 1385-94 |
| Authors | Kryger G, Harel M, Giles K, Toker L, Velan B, Lazar A, Kronman C, Barak D, Ariel N, Shafferman A, Silman I, Sussman JL |
| Title | Structures of recombinant native and E202Q mutant human acetylcholinesterase complexed with the snake-venom toxin fasciculin-II. |
| Related PDB | 1b41 1f8u |
| Related UniProtKB | P22303 |
| [44] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 10801325 |
| Journal | Biochemistry |
| Year | 2000 |
| Volume | 39 |
| Pages | 5750-7 |
| Authors | Wong L, Radic Z, Bruggemann RJ, Hosea N, Berman HA, Taylor P |
| Title | Mechanism of oxime reactivation of acetylcholinesterase analyzed by chirality and mutagenesis. |
| Related PDB | |
| Related UniProtKB | |
| [45] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 10732982 |
| Journal | Bioorg Med Chem |
| Year | 2000 |
| Volume | 8 |
| Pages | 653-6 |
| Authors | Hirashima A, Kuwano E, Eto M |
| Title | Docking study of enantiomeric fonofos oxon bound to the active site of Torpedo californica acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [46] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 10669619 |
| Journal | J Mol Biol |
| Year | 2000 |
| Volume | 296 |
| Pages | 713-35 |
| Authors | Koellner G, Kryger G, Millard CB, Silman I, Sussman JL, Steiner T |
| Title | Active-site gorge and buried water molecules in crystal structures of acetylcholinesterase from Torpedo californica. |
| Related PDB | |
| Related UniProtKB | |
| [47] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 10788331 |
| Journal | J Mol Biol |
| Year | 2000 |
| Volume | 298 |
| Pages | 705-26 |
| Authors | Van Belle D, De Maria L, Iurcu G, Wodak SJ |
| Title | Pathways of ligand clearance in acetylcholinesterase by multiple copy sampling. |
| Related PDB | |
| Related UniProtKB | |
| [48] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 10639129 |
| Journal | Proc Natl Acad Sci U S A |
| Year | 2000 |
| Volume | 97 |
| Pages | 623-8 |
| Authors | Weik M, Ravelli RB, Kryger G, McSweeney S, Raves ML, Harel M, Gros P, Silman I, Kroon J, Sussman JL |
| Title | Specific chemical and structural damage to proteins produced by synchrotron radiation. |
| Related PDB | 1qid 1qie 1qif 1qig 1qih 1qii 1qij 1qik 1qim |
| Related UniProtKB | |
| [49] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11171062 |
| Journal | Biochem J |
| Year | 2001 |
| Volume | 353 |
| Pages | 645-53 |
| Authors | Enyedy IJ, Kovach IM, Bencsura A |
| Title | Molecular dynamics study of active-site interactions with tetracoordinate transients in acetylcholinesterase and its mutants. |
| Related PDB | |
| Related UniProtKB | |
| [50] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11523986 |
| Journal | Biochemistry |
| Year | 2001 |
| Volume | 40 |
| Pages | 10447-57 |
| Authors | De Ferrari GV, Canales MA, Shin I, Weiner LM, Silman I, Inestrosa NC |
| Title | A structural motif of acetylcholinesterase that promotes amyloid beta-peptide fibril formation. |
| Related PDB | |
| Related UniProtKB | |
| [51] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11412096 |
| Journal | Biochemistry |
| Year | 2001 |
| Volume | 40 |
| Pages | 7433-45 |
| Authors | Kaplan D, Ordentlich A, Barak D, Ariel N, Kronman C, Velan B, Shafferman A |
| Title | Does "butyrylization" of acetylcholinesterase through substitution of the six divergent aromatic amino acids in the active center gorge generate an enzyme mimic of butyrylcholinesterase? |
| Related PDB | |
| Related UniProtKB | |
| [52] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11341833 |
| Journal | Biochemistry |
| Year | 2001 |
| Volume | 40 |
| Pages | 5682-90 |
| Authors | Massiah MA, Viragh C, Reddy PM, Kovach IM, Johnson J, Rosenberry TL, Mildvan AS |
| Title |
Short, |
| Related PDB | |
| Related UniProtKB | |
| [53] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 11563919 |
| Journal | J Med Chem |
| Year | 2001 |
| Volume | 44 |
| Pages | 3203-15 |
| Authors | Doucet-Personeni C, Bentley PD, Fletcher RJ, Kinkaid A, Kryger G, Pirard B, Taylor A, Taylor R, Taylor J, Viner R, Silman I, Sussman JL, Greenblatt HM, Lewis T |
| Title |
A structure-based design approach to the development of novel, |
| Related PDB | 1hbj |
| Related UniProtKB | |
| [54] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11708910 |
| Journal | J Med Chem |
| Year | 2001 |
| Volume | 44 |
| Pages | 4062-71 |
| Authors | Yu Q, Holloway HW, Flippen-Anderson JL, Hoffman B, Brossi A, Greig NH |
| Title | Methyl analogues of the experimental Alzheimer drug phenserine: synthesis and structure/activity relationships for acetyl- and butyrylcholinesterase inhibitory action. |
| Related PDB | |
| Related UniProtKB | |
| [55] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11449566 |
| Journal | J Mol Graph Model |
| Year | 2001 |
| Volume | 19 |
| Pages | 288-96, 374-8 |
| Authors | Pilger C, Bartolucci C, Lamba D, Tropsha A, Fels G |
| Title | Accurate prediction of the bound conformation of galanthamine in the active site of Torpedo californica acetylcholinesterase using molecular docking. |
| Related PDB | |
| Related UniProtKB | |
| [56] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11567086 |
| Journal | Protein Sci |
| Year | 2001 |
| Volume | 10 |
| Pages | 1953-61 |
| Authors | Weik M, Ravelli RB, Silman I, Sussman JL, Gros P, Kroon J |
| Title | Specific protein dynamics near the solvent glass transition assayed by radiation-induced structural changes. |
| Related PDB | |
| Related UniProtKB | |
| [57] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 11119642 |
| Journal | Proteins |
| Year | 2001 |
| Volume | 42 |
| Pages | 182-91 |
| Authors | Bartolucci C, Perola E, Pilger C, Fels G, Lamba D |
| Title | Three-dimensional structure of a complex of galanthamine (Nivalin) with acetylcholinesterase from Torpedo californica: implications for the design of new anti-Alzheimer drugs. |
| Related PDB | 1qti |
| Related UniProtKB | |
| [58] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 12069617 |
| Journal | Acc Chem Res |
| Year | 2002 |
| Volume | 35 |
| Pages | 332-40 |
| Authors | Shen T, Tai K, Henchman RH, McCammon JA |
| Title | Molecular dynamics of acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [59] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 12351819 |
| Journal | Acta Crystallogr D Biol Crystallogr |
| Year | 2002 |
| Volume | 58 |
| Pages | 1765-71 |
| Authors | Felder CE, Harel M, Silman I, Sussman JL |
| Title | Structure of a complex of the potent and specific inhibitor BW284C51 with Torpedo californica acetylcholinesterase. |
| Related PDB | 1e3q |
| Related UniProtKB | |
| [60] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 12081473 |
| Journal | Biochemistry |
| Year | 2002 |
| Volume | 41 |
| Pages | 8245-52 |
| Authors | Barak D, Kaplan D, Ordentlich A, Ariel N, Velan B, Shafferman A |
| Title | The aromatic "trapping" of the catalytic histidine is essential for efficient catalysis in acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [61] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 11888271 |
| Journal | Biochemistry |
| Year | 2002 |
| Volume | 41 |
| Pages | 3555-64 |
| Authors | Bar-On P, Millard CB, Harel M, Dvir H, Enz A, Sussman JL, Silman I |
| Title | Kinetic and structural studies on the interaction of cholinesterases with the anti-Alzheimer drug rivastigmine. |
| Related PDB | 1gqr 1gqs |
| Related UniProtKB | |
| [62] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 12196020 |
| Journal | Biochemistry |
| Year | 2002 |
| Volume | 41 |
| Pages | 10810-8 |
| Authors | Dvir H, Jiang HL, Wong DM, Harel M, Chetrit M, He XC, Jin GY, Yu GL, Tang XC, Silman I, Bai DL, Sussman JL |
| Title | X-ray structures of Torpedo californica acetylcholinesterase complexed with (+)-huperzine A and (-)-huperzine B: structural evidence for an active site rearrangement. |
| Related PDB | 1gpk 1gpn |
| Related UniProtKB | |
| [63] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 11863435 |
| Journal | Biochemistry |
| Year | 2002 |
| Volume | 41 |
| Pages | 2970-81 |
| Authors | Dvir H, Wong DM, Harel M, Barril X, Orozco M, Luque FJ, Munoz-Torrero D, Camps P, Rosenberry TL, Silman I, Sussman JL |
| Title | 3D structure of Torpedo californica acetylcholinesterase complexed with huprine X at 2.1 A resolution: kinetic and molecular dynamic correlates. |
| Related PDB | 1e66 |
| Related UniProtKB | |
| [64] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11904227 |
| Journal | Biochim Biophys Acta |
| Year | 2002 |
| Volume | 1594 |
| Pages | 313-24 |
| Authors | Masson P, Schopfer LM, Bartels CF, Froment MT, Ribes F, Nachon F, Lockridge O |
| Title | Substrate activation in acetylcholinesterase induced by low pH or mutation in the pi-cation subsite. |
| Related PDB | |
| Related UniProtKB | |
| [65] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 11920879 |
| Journal | Electrophoresis |
| Year | 2002 |
| Volume | 23 |
| Pages | 930-7 |
| Authors | Rochu D, Renault F, Masson P |
| Title | Detection of unwanted protein-bound ligands by capillary zone electrophoresis: the case of hidden ligands that stabilize cholinesterase conformation. |
| Related PDB | |
| Related UniProtKB | |
| [66] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | 12095250 |
| Journal | J Mol Biol |
| Year | 2002 |
| Volume | 320 |
| Pages | 721-5 |
| Authors | Koellner G, Steiner T, Millard CB, Silman I, Sussman JL |
| Title | A neutral molecule in a cation-binding site: specific binding of a PEG-SH to acetylcholinesterase from Torpedo californica. |
| Related PDB | 1jjb |
| Related UniProtKB | |
| [67] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 12731886 |
| Journal | Biochemistry |
| Year | 2003 |
| Volume | 42 |
| Pages | 5438-52 |
| Authors | Johnson JL, Cusack B, Davies MP, Fauq A, Rosenberry TL |
| Title |
Unmasking tandem site interaction in human acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [68] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 12601798 |
| Journal | Biopolymers |
| Year | 2003 |
| Volume | 68 |
| Pages | 395-406 |
| Authors | Zeev-Ben-Mordehai T, Silman I, Sussman JL |
| Title | Acetylcholinesterase in motion: visualizing conformational changes in crystal structures by a morphing procedure. |
| Related PDB | |
| Related UniProtKB | |
| [69] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 12505979 |
| Journal | EMBO J |
| Year | 2003 |
| Volume | 22 |
| Pages | 1-12 |
| Authors | Bourne Y, Taylor P, Radic Z, Marchot P |
| Title | Structural insights into ligand interactions at the acetylcholinesterase peripheral anionic site. |
| Related PDB | |
| Related UniProtKB | |
| [70] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 14622273 |
| Journal | Eur J Biochem |
| Year | 2003 |
| Volume | 270 |
| Pages | 4447-58 |
| Authors | Saxena A, Fedorko JM, Vinayaka CR, Medhekar R, Radic Z, Taylor P, Lockridge O, Doctor BP |
| Title | Aromatic amino-acid residues at the active and peripheral anionic sites control the binding of E2020 (Aricept) to cholinesterases. |
| Related PDB | |
| Related UniProtKB | |
| [71] | |
| Resource | |
| Comments | X-ray crystallography |
| Medline ID | |
| PubMed ID | |
| Journal | J Am Chem Soc |
| Year | 2003 |
| Volume | 125 |
| Pages | 363-3 |
| Authors | Wong DM, Greenblatt HM, Dvir H, Carlier PR, Han YF, Pang YP, Silman I, Sussman JL |
| Title | Acetylcholinesterase complexed with bivalent ligands related to huperzine A: experimental evidence for species-dependent protein-ligand complementarity. |
| Related PDB | 1h22 1h23 |
| Related UniProtKB | |
| [72] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 12759360 |
| Journal | J Biol Chem |
| Year | 2003 |
| Volume | 278 |
| Pages | 30905-11 |
| Authors | Shi J, Tai K, McCammon JA, Taylor P, Johnson DA |
| Title | Nanosecond dynamics of the mouse acetylcholinesterase cys69-cys96 omega loop. |
| Related PDB | |
| Related UniProtKB | |
| [73] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 14584959 |
| Journal | J Med Chem |
| Year | 2003 |
| Volume | 46 |
| Pages | 5087-90 |
| Authors | Zaheer-Ul-Haq ZU, Wellenzohn B, Liedl KR, Rode BM |
| Title | Molecular docking studies of natural cholinesterase-inhibiting steroidal alkaloids from Sarcococca saligna. |
| Related PDB | |
| Related UniProtKB | |
| [74] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 15023064 |
| Journal | Biochemistry |
| Year | 2004 |
| Volume | 43 |
| Pages | 3129-36 |
| Authors | Kaplan D, Barak D, Ordentlich A, Kronman C, Velan B, Shafferman A |
| Title | Is aromaticity essential for trapping the catalytic histidine 447 in human acetylcholinesterase? |
| Related PDB | |
| Related UniProtKB | |
| [75] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 15078872 |
| Journal | J Biol Chem |
| Year | 2004 |
| Volume | 279 |
| Pages | 26612-8 |
| Authors | Boyd AE, Dunlop CS, Wong L, Radic Z, Taylor P, Johnson DA |
| Title | Nanosecond dynamics of acetylcholinesterase near the active center gorge. |
| Related PDB | |
| Related UniProtKB | |
| [76] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 15267237 |
| Journal | J Med Chem |
| Year | 2004 |
| Volume | 47 |
| Pages | 3991-9 |
| Authors | Cavalli A, Bottegoni G, Raco C, De Vivo M, Recanatini M |
| Title | A computational study of the binding of propidium to the peripheral anionic site of human acetylcholinesterase. |
| Related PDB | |
| Related UniProtKB | |
| [77] | |
| Resource | |
| Comments | |
| Medline ID | |
| PubMed ID | 15563167 |
| Journal | J Am Chem Soc |
| Year | 2004 |
| Volume | 126 |
| Pages | 15405-11 |
| Authors | Greenblatt HM, Guillou C, Guenard D, Argaman A, Botti S, Badet B, Thal C, Silman I, Sussman JL |
| Title | The complex of a bivalent derivative of galanthamine with torpedo acetylcholinesterase displays drastic deformation of the active-site gorge: implications for structure-based drug design. |
| Related PDB | 1w4l 1w6r 1w75 1w76 |
| Related UniProtKB | |
| Comments |
|---|
|
According to the literature [1] & [24], Moreover, |
| Created | Updated |
|---|---|
| 2004-03-19 | 2012-02-21 |