Structure of PDB 3sdt Chain A Binding Site BS03 |
| >3sdt Chain A (length=775) Species: 46611 (Abies grandis)
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WGYDLVHSLKSPYIDSSYRERAEVLVSEIKAMLNPAITGDGESMITPSAY
DTAWVARVPAIDGSARPQFPQTVDWILKNQLKDGSWGIQSHFLLSDRLLA
TLSCVLVLLKWNVGDLQVEQGIEFIKSNLELVKDETDQDSLVTDFEIIFP
SLLREAQSLRLGLPYDLPYIHLLQTKRQERLAKLSREEIYAVPSPLLYSL
EGIQDIVEWERIMEVQSQDGSFLSSPASTACVFMHTGDAKCLEFLNSVMI
KFGNFVPCLYPVDLLERLLIVDNIVRLGIYRHFEKEIKEALDYVYRHWNE
RGIGWGRLNPIADLETTALGFRLLRLHRYNVSPAIFDNFKDAKFICSTGQ
FNKDVASMLNLYRASQLAFPGENILDEAKSFATKYLREALEKSETSSAWN
NKQNLSQEIKYALKTSWHASVPRVEAKRYCQVYRPDYARIAKCVYKLPYV
NNEKFLELGKLDFNIIQSIHQEEMKNVTSWFRDSGLPLFTFARERPLEFY
FLVAAGTYEPQYAKCRFLFTKVACLQTVLDDMYDTYGTLDELKLFTEAVR
RWDLSFTENLPDYMKLCYQIYYDIVHEVAWEAEKEQGRELVSFFRKGWED
YLLGYYEEAEWLAAEYVPTLDEYIKNGITSIGQRILLLSGVLIMDGQLLS
QEALEKVDYPGRRVLTELNSLISRLADDTKTYKALASSIECYMKDHPECT
EEEALDHIYSILEPAVKELTREFLKPDDVPFACKKMLFEETRVTMVIFKD
GDGFGVSKLEVKDHIKECLIEPLPL |
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| Ligand ID | AHD |
| InChI | InChI=1S/C4H13NO7P2/c5-3-1-2-4(6,13(7,8)9)14(10,11)12/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12)/p-4 |
| InChIKey | OGSPWJRAVKPPFI-UHFFFAOYSA-J |
| SMILES | | Software | SMILES |
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| OpenEye OEToolkits 1.7.2 | C(CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-])CN | | CACTVS 3.370 | NCCCC(O)([P]([O-])([O-])=O)[P]([O-])([O-])=O | | ACDLabs 12.01 | [O-]P([O-])(=O)C(O)(CCCN)P(=O)([O-])[O-] |
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| Formula | C4 H9 N O7 P2 |
| Name | 4-AMINO-1-HYDROXYBUTANE-1,1-DIYLDIPHOSPHONATE;
ALENDRONATE;
FOSAMAX (TM) |
| ChEMBL | |
| DrugBank | |
| ZINC |
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| PDB chain | 3sdt Chain A Residue 822
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