2026-02-28_00000112
|
hard
|
9LLI
Cryo-EM structure of D1R in complex with de novo designed GEM targeting TM1/2/4 and GEM targeting TM3/4/5, and negative allosteric GEM targeting TM5/6/7;
Electron microscopy 3.00Å
Protein #1
519 residues (66% resolved)
Raw Sequence ...
RTLNTSAMDGTGLVVERDFSVRILTACFLSLLILSTLLGNTLVCAAVIRFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVAEIAGFWPFGSFCNIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPKAAFILISVAWTLSVLISFIPVQLSNHKAKPTSPSDGNATSLAETIDNCDSSLSRTYAISSSVISFYIPVAIMIVTYTRIYRILKKELDALNDNWETLNDNLKVIEKADNAAQVKDALTKMRAAALDAQKATPPKLEDKSPDSPEMKDFRHGFDILVGQIDDALKLANEGKVKEAQAAAEQLKTTRDAILKPFIEELKELKGKPFLIDAVIMGVFVCCWLPFFILNCILPFCGSGETQPFCIDSNTFDVFVWFGWANSSLNPIIYAFNADFRKAFSTLLGCYRLCPATNNAIETVSINNNGAAMFSSHHEPRGSISKECNLVYLIPHAVGSSEDLKKEEAAGIARPLEKLSPALSVILDYDTDVSLEKIQPITQNGQHPTGGS
Canonical Sequence ...
RTLNTSAMDGTGLVVERDFSVRILTACFLSLLILSTLLGNTLVCAAVIRFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVAEIAGFWPFGSFCNIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPKAAFILISVAWTLSVLISFIPVQLSNHKAKPTSPSDGNATSLAETIDNCDSSLSRTYAISSSVISFYIPVAIMIVTYTRIYRILKKELDALNDNWETLNDNLKVIEKADNAAQVKDALTKMRAAALDAQKATPPKLEDKSPDSPEMKDFRHGFDILVGQIDDALKLANEGKVKEAQAAAEQLKTTRDAILKPFIEELKELKGKPFLIDAVIMGVFVCCWLPFFILNCILPFCGSGETQPFCIDSNTFDVFVWFGWANSSLNPIIYAFNADFRKAFSTLLGCYRLCPATNNAIETVSINNNGAAMFSSHHEPRGSISKECNLVYLIPHAVGSSEDLKKEEAAGIARPLEKLSPALSVILDYDTDVSLEKIQPITQNGQHPTGGS
Protein #2
97 residues (70% resolved)
Raw Sequence ...
DYKDDDDKEFLEVLFQGPMLLIIGTIITLVSSIIFLISFFRFMRKWIRGLTRRDVRRFLVVLLVFFLLFLISLLLYVLFLVLYFLSLGKIDPKTGSA
Canonical Sequence ...
DYKDDDDKEFLEVLFQGPMLLIIGTIITLVSSIIFLISFFRFMRKWIRGLTRRDVRRFLVVLLVFFLLFLISLLLYVLFLVLYFLSLGKIDPKTGSA
Protein #3
77 residues (86% resolved)
Raw Sequence ...
GPPLPLSKIVILLIILLILSIIFLLLLYLLIKYFKSFNEPIPPMLKVFLIYCVLSLIWVIIYTIIEVLELLLRPPPG
Canonical Sequence ...
GPPLPLSKIVILLIILLILSIIFLLLLYLLIKYFKSFNEPIPPMLKVFLIYCVLSLIWVIIYTIIEVLELLLRPPPG
Protein #4
95 residues (69% resolved)
Raw Sequence ...
PSPVPPPPPPLPIWKILLIIGTILYIVVFLYISIFLYRLLKTFVPKEERKKWFKFLGILFLIFLILLIYFVVYVIRVLFPPPPPPSPGPPPPPPP
Canonical Sequence ...
PSPVPPPPPPLPIWKILLIIGTILYIVVFLYISIFLYRLLKTFVPKEERKKWFKFLGILFLIFLILLIYFVVYVIRVLFPPPPPPSPGPPPPPPP
Non polymer #5
A1EKL
InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5-
InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5-
SMILES: c1ccc2c(c1)/C(=C/CCN3CCN(CC3)CCO)/c4cc(ccc4S2)C(F)(F)F
c1ccc2c(c1)/C(=C/CCN3CCN(CC3)CCO)/c4cc(ccc4S2)C(F)(F)F
Biounit #1
hetero-1-1-1-1-mer
Download coordinates
Tube
Model
Reference
100%