ENAH EVH1 in complex with Ac-[2-Cl-F]-[ProM-1]-[ProM-1]-OH

ENAH EVH1 in complex with Ac-[2-Cl-F]-[ProM-1]-[ProM-1]-OH Descriptor: (3~{S},7~{R},10~{R},13~{S})-4-[[(3~{R},7~{S},10~{S},13~{R})-4-[(2~{S})-2-acetamido-3-(2-chlorophenyl)propanoyl]-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-en-13-yl]carbonyl]-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-ene-13-carboxylic acid, (3~{S},7~{R},10~{R},13~{S})-4-[[(3~{S},7~{R},10~{R},13~{S})-4-[(2~{S})-2-acetamido-3-(2-chlorophenyl)propanoyl]-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-en-13-yl]carbonyl]-2-oxidanylidene-1,4-diazatricyclo[8.3.0.0^{3,7}]tridec-8-ene-13-carboxylic acid, CHLORIDE ION, ... Authors: Barone, M, Roske, Y. Deposit date: 2017-02-28 Release date: 2017-05-24 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.46 Å) Cite: Designed nanomolar small-molecule inhibitors of Ena/VASP EVH1 interaction impair invasion and extravasation of breast cancer cells. Proc.Natl.Acad.Sci.USA, 117, 2020

与Ac-[2-Cl-F]-[ProM-1]-[ProM-1]-OH结合的ENAH EVH1结构域复合物。结构描述符：(3S,7R,10R,13S)-4-[[(3R,7S,10S,13R)-4-[(2S)-2-乙酰氨基-3-(2-氯苯基)丙酰基]-2-氧代-1,4-二氮杂三环[8.3.0.0^{3,7}]十三碳-8-烯-13-基]羰基]-2-氧代-1,4-二氮杂三环[8.3.0.0^{3,7}]十三碳-8-烯-13-羧酸、(3S,7R,10R,13S)-4-[[(3S,7R,10R,13S)-4-[(2S)-2-乙酰氨基-3-(2-氯苯基)丙酰基]-2-氧代-1,4-二氮杂三环[8.3.0.0^{3,7}]十三碳-8-烯-13-基]羰基]-2-氧代-1,4-二氮杂三环[8.3.0.0^{3,7}]十三碳-8-烯-13-羧酸、氯离子……作者：Barone, M、Roske, Y。存档日期：2017-02-28。发布日期：2017-05-24。最后修改日期：2024-01-31。测定方法：X射线衍射（分辨率1.46埃）。引用文献：靶向Ena/VASP EVH1相互作用的纳摩尔级设计小分子抑制剂可抑制乳腺癌细胞的侵袭与外渗。《美国国家科学院院刊》，117卷，2020年