2026-03-21_00000046|ligand|9JJZ

Crystal Structure of human Pin1 catalytic domain in complex with a covalent inhibitor; X-ray diffraction 1.61Å
Protein #1 121 residues (95% resolved)

GPGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEQITRTQEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE

GPGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEQITRTQEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE
Non polymer #2 A1ECA

InChI=1S/C14H23NO5S/c1-14(2,3)10-15(11-7-8-21(18,19)9-11)12(16)5-6-13(17)20-4/h5-6,11H,7-10H2,1-4H3/b6-5-/t11-/m0/s1

CC(C)(C)CN([C@H]1CCS(=O)(=O)C1)C(=O)C=CC(=O)OC
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Reference