Structure of PDB 5a5l Chain A Binding Site BS01 |
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| Ligand ID | VTB |
| InChI | InChI=1S/C7H15O10P/c8-2-7(12)6(11)5(10)4(9)3(17-7)1-16-18(13,14)15/h3-6,8-12H,1-2H2,(H2,13,14,15)/t3-,4+,5+,6-,7+/m0/s1 |
| InChIKey | CBIDVWSRUUODHL-CXNFULCWSA-N |
| SMILES | | Software | SMILES |
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| CACTVS 3.385 | OC[C]1(O)O[CH](CO[P](O)(O)=O)[CH](O)[CH](O)[CH]1O | | OpenEye OEToolkits 2.0.6 | C(C1C(C(C(C(O1)(CO)O)O)O)O)OP(=O)(O)O | | CACTVS 3.385 | OC[C@@]1(O)O[C@@H](CO[P](O)(O)=O)[C@@H](O)[C@@H](O)[C@@H]1O | | OpenEye OEToolkits 2.0.6 | C([C@H]1[C@H]([C@H]([C@@H]([C@](O1)(CO)O)O)O)O)OP(=O)(O)O |
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| Formula | C7 H15 O10 P |
| Name | 7-O-phosphono-alpha-L-galacto-hept-2-ulopyranose;
[(2~{S},3~{S},4~{R},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate;
7-O-phosphono-alpha-L-galacto-hept-2-ulose;
7-O-phosphono-L-galacto-hept-2-ulose;
7-O-phosphono-galacto-hept-2-ulose |
| ChEMBL | |
| DrugBank | |
| ZINC | ZINC000015273183
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| PDB chain | 5a5l Chain A Residue 1339
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| Enzyme Commision number |
3.1.3.11: fructose-bisphosphatase.
3.1.3.37: sedoheptulose-bisphosphatase. |
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