Structure of PDB 7b05 Chain B Binding Site BS04 |
| >7b05 Chain B (length=645) Species: 7955 (Danio rerio)
[Search protein sequence]
[Download receptor structure]
[Download structure with residue number starting from 1]
[View receptor structure]
|
LSTQEKSYLSAVEKGDYASVKLALEEAEIYFKININCIDPLGRTALLIAI
ENENLEIIELLLSFNVYVGDALLHAIRKEVVGAVELLLNHQFSDFTPDIT
PIILAAHTNNYEIIKMLVQKGVSVPQPHEVVDSLRHSRSRLNIYKALASP
SLIALSSEDPFLTAFQLSWELQELSKVENEFKAEYEELSHQCKHFAKDLL
DQTRSSRELELILNFRNELARLKLAIKYRQKEFVAQPNCQQLLASRWYDE
RHWAGKLITCVFIGLMFPLLSLCYLVAPKSRYGLFIRKPFIKFICHTASY
LTFLFLLLLASQHIVSNNPDRQGPKPTTVEWMILPWVLGFIWTEIKQMWD
GGFQDYIHDWWNLMDFVMNSLYLATISLKIVAYVKYSGCKPRDTWEMWHP
TLVAEAVFAIANIFSSLRLISLFTANSHLGPLQISLGRMLLDILKFLFIY
CLVLLAFANGLNQLYFYYENSEGMTCKGIRCERQNNAFSTLFETLQSLFW
SIFGLISLYVTNVKADHKFTEFVGATMFGTYNVISLVVLLNMLIAMMNNS
YQHIADHADIEWKFARTKLWMSYFEEGGTLPPPFNIAENVRLNHQYQEVL
RNLVKRYVAAMIRDAKTEEGLTEENFKELKQDISSFRYEVIGMMK |
|
|
| Ligand ID | 44E |
| InChI | InChI=1S/C15H29O8P/c1-3-5-7-9-14(16)21-11-13(12-22-24(18,19)20)23-15(17)10-8-6-4-2/h13H,3-12H2,1-2H3,(H2,18,19,20)/t13-/m1/s1 |
| InChIKey | SFZZRGHNPILUOD-CYBMUJFWSA-N |
| SMILES | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.9.2 | CCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCC | | CACTVS 3.385 | CCCCCC(=O)OC[CH](CO[P](O)(O)=O)OC(=O)CCCCC | | CACTVS 3.385 | CCCCCC(=O)OC[C@H](CO[P](O)(O)=O)OC(=O)CCCCC | | ACDLabs 12.01 | O=C(OC(COP(=O)(O)O)COC(=O)CCCCC)CCCCC | | OpenEye OEToolkits 1.9.2 | CCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCC |
|
| Formula | C15 H29 O8 P |
| Name | (2R)-3-(phosphonooxy)propane-1,2-diyl dihexanoate |
| ChEMBL | |
| DrugBank | |
| ZINC |
|
| PDB chain | 7b05 Chain C Residue 1003
[Download ligand structure]
[Download structure with residue number starting from 1]
[View ligand structure]
|
|
|
|
|
| Enzyme Commision number |
? |
|
|
|
|
|
