2025-03-22_00000237
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ligand
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9EX4
CryoEM structure of sTeLIC nanodisc in complex with fluorinated fos-choline-8 in open state;
Electron microscopy 2.19Å
Protein #1
320 residues (97% resolved)
Raw Sequence ...
MASLAAEPSDVFIGLKIDQITGINQKEENFSVVGSLRIDWRQPLLAFEHAPGEPKHRTYTLATFLKLLEEKQIRWPAFTYHNQQGRMDFQNRLISLSEDGTVMYLERFTSTFQAPAFDFRLFPFDNQLFFIHVDSIFPQHLFRFQEMQGFSGLGDQLGEEEWIVTEVNTHLTTHNEFTKGDASRFVLEFHAERHLNYYLMRILIPVLLIITVSWFTFFLQDYTKRIDLAGGNLLLFIAFNFTISSDLPRLGYITLMDAFLVGTFIITALVVLGNVWLRRLENHGKQALARKLDIYAITSYPLAYLLGALTLWLLFFWRSY
Canonical Sequence ...
MASLAAEPSDVFIGLKIDQITGINQKEENFSVVGSLRIDWRQPLLAFEHAPGEPKHRTYTLATFLKLLEEKQIRWPAFTYHNQQGRMDFQNRLISLSEDGTVMYLERFTSTFQAPAFDFRLFPFDNQLFFIHVDSIFPQHLFRFQEMQGFSGLGDQLGEEEWIVTEVNTHLTTHNEFTKGDASRFVLEFHAERHLNYYLMRILIPVLLIITVSWFTFFLQDYTKRIDLAGGNLLLFIAFNFTISSDLPRLGYITLMDAFLVGTFIITALVVLGNVWLRRLENHGKQALARKLDIYAITSYPLAYLLGALTLWLLFFWRSY
Non polymer #2
A1H8K
InChI=1S/C13H17F13NO4P/c1-27(2,3)5-7-31-32(28,29)30-6-4-8(14,15)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h4-7H2,1-3H3/p+1
InChI=1S/C13H17F13NO4P/c1-27(2,3)5-7-31-32(28,29)30-6-4-8(14,15)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h4-7H2,1-3H3/p+1
SMILES: C[N+](C)(C)CCOP(=O)(O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
C[N+](C)(C)CCOP(=O)(O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Non polymer #3
EPE
InChI=1S/C8H18N2O4S/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14/h11H,1-8H2,(H,12,13,14)
InChI=1S/C8H18N2O4S/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14/h11H,1-8H2,(H,12,13,14)
SMILES: C1CN(CCN1CCO)CCS(=O)(=O)O
C1CN(CCN1CCO)CCS(=O)(=O)O
Non polymer #4
HEX
InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
SMILES: CCCCCC
CCCCCC
Biounit #1
homo-pentamer
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Model
Reference
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