Crystal structure of human CARM1 with (S)-SKI-72

Crystal structure of human CARM1 with (S)-SKI-72 Descriptor: (2S,5S)-2-amino-6-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]-5-[(benzylamino)methyl]-N-[2-(4-hydroxyphenyl)ethyl]hexanamide, GLYCEROL, Histone-arginine methyltransferase CARM1, ... Authors: DONG, A, ZENG, H, WALKER, J.R, Hutchinson, A, Seitova, A, LUO, M, CAI, X.C, KE, W, WANG, J, SHI, C, ZHENG, W, LEE, J.P, IBANEZ, G, Bountra, C, Arrowsmith, C.H, Edwards, A.M, BROWN, P.J, WU, H, Structural Genomics Consortium (SGC) Deposit date: 2018-04-13 Release date: 2018-05-23 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2 Å) Cite: A chemical probe of CARM1 alters epigenetic plasticity against breast cancer cell invasion. Elife, 8, 2019

结合(S)-SKI-72的人源CAR M1晶体结构，描述符为：(2S,5S)-2-氨基-6-[(2R,3S,4R,5R)-5-(6-氨基-9H-嘌呤-9-基)-3,4-二羟基四氢呋喃-2-基]-5-[(苄基氨基)甲基]-N-[2-(4-羟基苯基)乙基]己酰胺、甘油（GLYCEROL）、组蛋白精氨酸甲基转移酶CAR M1（Histone-arginine methyltransferase CARM1）等。作者包括DONG A、ZENG H、WALKER J.R.、Hutchinson A、Seitova A、LUO M、CAI X.C.、KE W、WANG J、SHI C、ZHENG W、LEE J.P.、IBANEZ G、Bountra C、Arrowsmith C.H.、Edwards A.M.、BROWN P.J.、WU H，以及结构基因组学联合会（Structural Genomics Consortium, SGC）。该数据集存放日期为2018-04-13，发布日期为2018-05-23，最后修改日期为2023-08-16。实验方法为X射线衍射（2 Å分辨率）。引用文献：《CARM1化学探针可改变表观遗传可塑性以抑制乳腺癌细胞侵袭》，发表于Elife, 8, 2019。