Structure of PDB 7exp Chain A Binding Site BS02 |
>7exp Chain A (length=574) Species: 7955 (Danio rerio)
[Search protein sequence]
[Download receptor structure]
[Download structure with residue number starting from 1]
[View receptor structure]
|
TLHNIITDTENVQGSFSKHEFQAETKKLLDIVARSLYSEKEVFIRELISN GSDALEKLRHRMITAGGDAPMEIHLQTDSVKGTFTIQDTGVGMNKEDLVS NLGTIARSGSKAFLDALQNQAEASSSIIGQFGVGFYSAFMVADKVEVYSQ SAEAAPGYKWSSDGSGVFEVAEASGVRQGTKIVLHLKDDCKEFSSEDRVK EVVTKYSNFVSFPIFLNGRRLNTLQALWMMEPKDISEWQHEEFYRYVAQA YDKPRYTLHYRADAPLNIRSIFYVPEMKPSVALYSRKILIQTKATDILPK WLRFLRGVVDSEDIPLNLSRELLQESALIRKLRDVLQQRVIRFLLDQSKK DPEKYARFFEDYGLFMREGIVTTGEQSVKEDIAKLLRFESSALPAGQQTS LMEYSSRMGTRNIYYLCAPNRHLAEHSPYFEAMEVLFCFEQFDELTLLHL REFDRKKLISAELSSEQAEDLLAWMRNALVRVTNIKVTDTHPAMITVLEM GAARHFLRQPTLEINTGHDLIKKLHALKDSNPELAQLLLEQIYDNAMIAA GLNEDPRPMISRLNQLLTRALEKH |
|
|
Ligand ID | 05M |
InChI | InChI=1S/C37H45O4P/c1-29-33(35(39)37(41-3)36(40-2)34(29)38)27-19-8-6-4-5-7-9-20-28-42(30-21-13-10-14-22-30,31-23-15-11-16-24-31)32-25-17-12-18-26-32/h10-18,21-26,42H,4-9,19-20,27-28H2,1-3H3 |
InChIKey | BIPKQWZPPRRUAP-UHFFFAOYSA-N |
SMILES | Software | SMILES |
---|
OpenEye OEToolkits 2.0.7 | CC1=C(C(=O)C(=C(C1=O)OC)OC)CCCCCCCCCCP(c2ccccc2)(c3ccccc3)c4ccccc4 | CACTVS 3.385 | COC1=C(OC)C(=O)C(=C(C)C1=O)CCCCCCCCCC[PH](c2ccccc2)(c3ccccc3)c4ccccc4 |
|
Formula | C37 H45 O4 P |
Name | 2,3-dimethoxy-5-methyl-6-[10-(triphenyl-$l^{5}-phosphanyl)decyl]cyclohexa-2,5-diene-1,4-dione |
ChEMBL | |
DrugBank | |
ZINC |
|
PDB chain | 7exp Chain A Residue 805
[Download ligand structure]
[Download structure with residue number starting from 1]
[View ligand structure]
|
|
|
|
Enzyme Commision number |
? |
|
|
|