Ligand |
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| Ligand Name: ara-F-ribose-5'-phosphate | ||
| Canonical SMILES: O=P([O-])([O-])OC[C@@H]1[C@@H](O)[C@H](F)[C@H](O1)O | ||
| Standard InChI: InChI=1S/C5H10FO7P/c6-3-4(7)2(13-5(3)8)1-12-14(9,10)11/h2-5,7-8H,1H2,(H2,9,10,11)/p-2/t2-,3+,4-,5+/m1/s1 | ||
| HET Code: RF5 | PubChem: - | |
| DrugBank: - | ChEMBL: - | |
| Molecular Formula: C5H8FO7P-2 | Mol. Weight: 230.00026 | logP: -2.7521 |
| HBD: 2 | HBA: 7 | |
| #Rotatable Bonds: 3 | TPSA: 122.11 | |
Covalent Mechanism |
Reaction Name | Residue | Chain ID | SASA | pKa | Warhead Name | Warhead Structure |
| Nucleophilic Acyl Substitution | GLU 226 | A | 19.22 | 9.28 | Hemiacetal |  |
Binding Affinity |
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- |