2026-07-11_00000209
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ligand
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9VT5
Estrogen Receptor Alpha Ligand Binding Domain Y537S Mutant in Complex with Compound 4 and GRIP Peptide;
X-ray diffraction 2.27Å
Protein #1
267 residues (87% resolved)
Raw Sequence ...
GSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLSDLLLEMLDAHRLHAPTSAILHRLLQAILHRLLQ
Canonical Sequence ...
GSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLSDLLLEMLDAHRLHAPTSAILHRLLQAILHRLLQ
Non polymer #2
A1ETI
InChI=1S/C28H19N3O2S2/c32-22-11-7-20(8-12-22)31(21-9-13-23(33)14-10-21)19-5-3-18(4-6-19)24-15-16-25(26-2-1-17-34-26)28-27(24)29-35-30-28/h1-17,32-33H
InChI=1S/C28H19N3O2S2/c32-22-11-7-20(8-12-22)31(21-9-13-23(33)14-10-21)19-5-3-18(4-6-19)24-15-16-25(26-2-1-17-34-26)28-27(24)29-35-30-28/h1-17,32-33H
SMILES: c1cc(sc1)c2ccc(c3c2nsn3)c4ccc(cc4)N(c5ccc(cc5)O)c6ccc(cc6)O
c1cc(sc1)c2ccc(c3c2nsn3)c4ccc(cc4)N(c5ccc(cc5)O)c6ccc(cc6)O
Biounit #1
homo-dimer
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Model
Reference
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