Structure of PDB 2ogd Chain A Binding Site BS03 |
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Ligand ID | SUF |
InChI | InChI=1S/C4H14O7P2S/c1-14(2)3-4(5,12(6,7)8)13(9,10)11/h5,14H,3H2,1-2H3,(H2,6,7,8)(H2,9,10,11) |
InChIKey | QRMZYUMGWARYEI-UHFFFAOYSA-N |
SMILES | Software | SMILES |
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OpenEye OEToolkits 1.5.0 | CS(C)CC(O)(P(=O)(O)O)P(=O)(O)O | CACTVS 3.341 | C[SH](C)CC(O)([P](O)(O)=O)[P](O)(O)=O | ACDLabs 10.04 | O=P(O)(O)C(O)(P(=O)(O)O)CS(C)C |
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Formula | C4 H14 O7 P2 S |
Name | [2-(DIMETHYL-LAMBDA~4~-SULFANYL)-1-HYDROXYETHANE-1,1-DIYL]BIS(PHOSPHONIC ACID) |
ChEMBL | |
DrugBank | |
ZINC |
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PDB chain | 2ogd Chain A Residue 3001
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