UniProt Q81EJ6
Peptidoglycan N-acetylglucosamine deacetylase (Q81EJ6)
Peptidoglycan N-acetylglucosamine deacetylase (UniProt Q81EJ6), EC 3.5.1.-: 10 experimental structures and 1 predicted model on GenesisL1, 6 ligands bound, 15 pockets. Binding sites, druggability and experiment against prediction…
- UniProt
- Q81EJ6
- Protein
- Peptidoglycan N-acetylglucosamine deacetylase
- EC
- 3.5.1.-
- Experimental structures
- 10
- Predicted models
- 1
- Ligands
- 6
- Pockets
- 15 · 3 records with a druggable one
Structures
11 records of Q81EJ6 in the MolNFT archive: 10 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 5N1J | Crystal structure of the polysaccharide deacetylase Bc1974 from Bacillus cereus | x-ray diffraction | A, B, C, D | ZN | 5 (best 0.81) |
| 5N1J | Crystal structure of the polysaccharide deacetylase BC1974 from bacillus cereus | x-ray diffraction | A, B, C, D | ZN | — |
| 5N1P | Crystal structure of the polysaccharide deacetylase Bc1974 from Bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | 8GK, ZN, NA | — |
| 5N1P | Crystal structure of the polysaccharide deacetylase BC1974 from bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | 8GK, ZN, NA | — |
| 5NC9 | Crystal structure of the polysaccharide deacetylase Bc1974 from Bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | 8SZ, ZN | 3 (best 0.81) |
| 5NC9 | Crystal structure of the polysaccharide deacetylase BC1974 from bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | 8SZ, ZN | — |
| 5NEK | Crystal structure of the polysaccharide deacetylase Bc1974 from Bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | ZN, AZM | 6 (best 0.79) |
| 5NEK | Crystal structure of the polysaccharide deacetylase BC1974 from bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | ZN, AZM | — |
| 5NEL | Crystal structure of the polysaccharide deacetylase Bc1974 from Bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | ZN, NHT | — |
| 5NEL | Crystal structure of the polysaccharide deacetylase BC1974 from bacillus cereus in complex with… | x-ray diffraction | A, B, C, D | ZN, NHT | — |
| Q81EJ6 | AlphaFold monomer V2.0 prediction for peptidoglycan-N- acetylglucosamine deacetylase BC_1974… | predicted | A | — | 1 (best 0.39) |
Ligands
- ZN · Zinc ion · in 10 records
- 8GK · ~{N}-oxidanylnaphthalene-1-carboxamide · in 2 records
- 8SZ · (2~{S})-2,6-bis(azanyl)-~{N}-oxidanyl-hexanamide · in 2 records
- AZM · 5-acetamido-1,3,4-thiadiazole-2-sulfonamide · in 2 records
- NA · Sodium ion · in 2 records
- NHT · (3ar,5r,6s,7r,7ar)-2-(ethylamino)-5-(hydroxymethyl)-5, 6,7,7A-tetrahydro-3AH-pyrano[3,2-d][1,3]thiazole-6,7-diol · in 2 records
Experiment against prediction
- 5N1J chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.22 Å
- 5N1J chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.22 Å
- 5N1P chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.24 Å
- 5N1P chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.24 Å
- 5NC9 chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.25 Å
- 5NC9 chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.25 Å
- 5NEL chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.29 Å
- 5NEL chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.29 Å
- 5NEK chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.29 Å
- 5NEK chain A against the predicted model Q81EJ6: TM-score 1.00, RMSD 0.29 Å
Elsewhere
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