PDB Entry (1qwn) |
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PDB ID: 1qwn | Resolution: 1.2 Å | Exp. Method: X-RAY DIFFRACTION |
PMID: 12960159 | DOI: 10.1074/jbc.M309249200 | |
Protein |
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Protein Name: Alpha-mannosidase 2 | |
Uniprot ID/ACC: Q24451 (MAN2_DROME) | Organism: Drosophila melanogaster (Fruit fly) |
Gene Symbol: alphaManIIa | Gene ID: 41126 |
Protein Class: HYDROLASE |
Ligand |
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Ligand Name: 5-FLUORO-BETA-L-GULOSYL FLUORIDE | ||
Canonical SMILES: OC[C@@]1(F)[C@@H](O)[C@H](O)[C@@H]([C@@H](O1)F)O | ||
Standard InChI: InChI=1S/C6H10F2O5/c7-5-3(11)2(10)4(12)6(8,1-9)13-5/h2-5,9-12H,1H2/t2-,3+,4+,5-,6+/m1/s1 | ||
HET Code: GUL | PubChem: - | |
DrugBank: - | ChEMBL: - | |
Molecular Formula: C6H10F2O5 | Mol. Weight: 200.04964 | logP: -1.947 |
HBD: 4 | HBA: 5 | |
#Rotatable Bonds: 1 | TPSA: 90.15 |
Covalent Mechanism |
Reaction Name | Residue | Chain ID | SASA | pKa | Warhead Name | Warhead Structure |
Nucleophilic Acyl Substitution | ASP 204 | A | 13.86 | -2.37 | Hemiacetal |
Binding Affinity |
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