UniProt Q9HUP2
ChoE (Q9HUP2)
ChoE (UniProt Q9HUP2), EC 3.1.-.-: 20 experimental structures on GenesisL1, 8 ligands bound, 57 pockets. Binding sites, pockets, druggability and 3D structures in GL1X.
- UniProt
- Q9HUP2
- Protein
- ChoE
- EC
- 3.1.-.-
- Experimental structures
- 20
- Predicted models
- 0
- Ligands
- 8
- Pockets
- 57 · 10 records with a druggable one
Structures
20 records of Q9HUP2 in the MolNFT archive: 20 experimental, 0 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 6UQV | Crystal structure of ChoE, a bacterial acetylcholinesterase from Pseudomonas aeruginosa | x-ray diffraction | A | BUA, CL | 2 (best 0.49) |
| 6UQV | Crystal structure of choe, a bacterial acetylcholinesterase from pseudomonas aeruginosa | x-ray diffraction | A | BUA, CL | — |
| 6UQW | Crystal structure of ChoE in complex with acetate and thiocholine | x-ray diffraction | A, B | ETM | 5 (best 0.54) |
| 6UQW | Crystal structure of choe in complex with acetate and thiocholine | x-ray diffraction | A, B | ETM | — |
| 6UQX | Crystal structure of ChoE in complex with propionylthiocholine | x-ray diffraction | A, B | QFJ, IOD, ETM | 5 (best 0.52) |
| 6UQX | Crystal structure of choe in complex with propionylthiocholine | x-ray diffraction | A, B | QFJ, IOD, ETM | — |
| 6UQY | Crystal structure of ChoE H288N mutant in complex with acetylthiocholine | x-ray diffraction | A, B | AT3 | 6 (best 0.52) |
| 6UQY | Crystal structure of choe H288N mutant in complex with acetylthiocholine | x-ray diffraction | A, B | AT3 | — |
| 6UQZ | Crystal structure of ChoE D285N mutant in complex with acetate and thiocholine | x-ray diffraction | A, B | ETM | 5 (best 0.51) |
| 6UQZ | Crystal structure of choe D285N mutant in complex with acetate and thiocholine | x-ray diffraction | A, B | ETM | — |
| 6UR0 | Crystal structure of ChoE D285N mutant acyl-enzyme | x-ray diffraction | A, B | ETM | 5 (best 0.49) |
| 6UR0 | Crystal structure of choe D285N mutant acyl-enzyme | x-ray diffraction | A, B | ETM | — |
| 6UR1 | Crystal structure of ChoE S38A mutant in complex with acetate and acetylthiocholine | x-ray diffraction | A, B | AT3 | 5 (best 0.57) |
| 6UR1 | Crystal structure of choe S38A mutant in complex with acetate and acetylthiocholine | x-ray diffraction | A, B | AT3 | — |
| 8D8W | Crystal structure of ChoE with Ser38 adopting alternative conformations | x-ray diffraction | A, B | IOD | 4 (best 0.49) |
| 8D8X | Crystal structure of ChoE in complex with acetate and thiocholine (crystal form 2) | x-ray diffraction | A | ETM, CL | 2 (best 0.51) |
| 8D8Y | Crystal structure of ChoE N147A mutant in complex with acetylthiocholine | x-ray diffraction | A, B | AT3, CL, ETM | 6 (best 0.55) |
| 8D8Z | Crystal structure of ChoE N147A mutant in complex with thiocholine and chloride | x-ray diffraction | A, B | CL, ETM | 5 (best 0.55) |
| 8D90 | Crystal structure of ChoE N147A mutant in complex with bromide ions | x-ray diffraction | A, B | BR | 3 (best 0.55) |
| 8D91 | Crystal structure of ChoE in complex with acetate and tetraethylammonium (TEA) | x-ray diffraction | A, B | NET | 4 (best 0.56) |
Ligands
- ETM · 2-(trimethylammonium)ethyl thiol · in 11 records
- AT3 · Acetylthiocholine · in 5 records
- CL · Chloride ion · in 5 records
- IOD · Iodide ion · in 3 records
- BUA · butanoic acid · in 2 records
- QFJ · propionylthiocholine · in 2 records
- BR · Bromide ion · in 1 record
- NET · Tetraethylammonium ion · in 1 record
Elsewhere
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