2025-03-22_00000167|hard|9CO5

Crystal Structure of Macrocycle mediated complex of FKBP12 and MAPRE1; X-ray diffraction 2.77Å
Protein #1 109 residues (100% resolved)

SMGVQVETISPGDGRTFPKRGQTCVVHYTGMLEDGKKFDSSRDRNKPFKFMLGKQEVIRGWEEGVAQMSVGQRAKLTISPDYAYGATGHPGIIPPHATLVFDVELLKLE

SMGVQVETISPGDGRTFPKRGQTCVVHYTGMLEDGKKFDSSRDRNKPFKFMLGKQEVIRGWEEGVAQMSVGQRAKLTISPDYAYGATGHPGIIPPHATLVFDVELLKLE
Protein #2 60 residues (100% resolved)

AAELMQQVNVLKLTVEDLEKERDFYFGKLRNIELICQENEGENDPVLQRIVDILYATDEG

AAELMQQVNVLKLTVEDLEKERDFYFGKLRNIELICQENEGENDPVLQRIVDILYATDEG
Non polymer #3 A1AZI

InChI=1S/C41H51N3O11/c1-25-17-19-43-31(20-25)37(47)42-26(2)39(49)54-24-41(3,4)36(46)38(48)44-18-8-7-12-30(44)40(50)55-32(28-10-9-11-29(22-28)53-23-35(43)45)15-13-27-14-16-33(51-5)34(21-27)52-6/h9-11,14,16,21-22,26,30-32H,1,7-8,12-13,15,17-20,23-24H2,2-6H3,(H,42,47)/t26-,30-,31+,32+/m0/s1

C[C@H]1C(=O)OCC(C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@@H](c3cccc(c3)OCC(=O)N4CCC(=C)C[C@@H]4C(=O)N1)CCc5ccc(c(c5)OC)OC)(C)C
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Reference