2025-04-26_00000012|ligand|8VZ3

Structure of human PIN1 covalently derivatized with SuFEx compound; X-ray diffraction 1.65Å
Protein #1 167 residues (87% resolved)

GSHGMADEEKLPPGWEKRMSRSSGRVYYFNHITNASQWERPSGNSSSGGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEKITRTKEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE

GSHGMADEEKLPPGWEKRMSRSSGRVYYFNHITNASQWERPSGNSSSGGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEKITRTKEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE
Non polymer #2 A1AEL

InChI=1S/C14H14FNO6S/c15-23(21,22)11-5-9(4-10(6-11)14(19)20)13(18)16-7-8-2-1-3-12(8)17/h4-6,8H,1-3,7H2,(H,16,18)(H,19,20)/t8-/m0/s1

c1c(cc(cc1C(=O)O)S(=O)(=O)F)C(=O)NC[C@@H]2CCCC2=O
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Reference