2025-09-13_00000160|ligand|9PW7

Myeloid cell leukemia-1 (Mcl-1) complexed with compound 13; X-ray diffraction 1.95Å
Protein #1 517 residues (99% resolved)

GKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTGSELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFH

GKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTGSELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFH
Non polymer #2 A1CL6

InChI=1S/C42H43Cl2N5O7/c1-22-15-25(16-23(2)36(22)44)56-14-7-9-26-27-10-11-30(43)35-29-20-46(4)45-31(29)21-55-13-8-12-47-33(42(51)52)17-28-37(47)32(18-34(53-5)40(28)54-6)48-19-24(3)49(38(27)35)39(26)41(48)50/h10-11,15-18,20,24H,7-9,12-14,19,21H2,1-6H3,(H,51,52)/t24-/m1/s1

Cc1cc(cc(c1Cl)C)OCCCc2c3ccc(c-4c3n5c2C(=O)N(C[C@H]5C)c6cc(c(c7c6n(c(c7)C(=O)O)CCCOCc8c4cn(n8)C)OC)OC)Cl
Download coordinates
Reference