2024-06-08_00000188|ligand|8VZQ

Crystal Structure of the ER-alpha Ligand-binding Domain (L372S, L536S) in complex with k-406; X-ray diffraction 1.75Å
Protein #1 242 residues (98% resolved)

SLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTSHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPSYDLLLEMLDA

SLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTSHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPSYDLLLEMLDA
Non polymer #2 A1AHX

InChI=1S/C29H30FNO6S/c1-29(2,30)17-31(20-8-14-23(36-3)15-9-20)38(34,35)25-16-24-26(18-4-10-21(32)11-5-18)27(28(25)37-24)19-6-12-22(33)13-7-19/h4-15,24-25,28,32-33H,16-17H2,1-3H3/t24-,25+,28+/m0/s1

CC(C)(CN(c1ccc(cc1)OC)S(=O)(=O)[C@@H]2C[C@H]3C(=C([C@@H]2O3)c4ccc(cc4)O)c5ccc(cc5)O)F
Non polymer #3 NI

InChI=1S/Ni/q+2

[Ni+2]
Download coordinates
Download coordinates
Reference