6I8B

Crystal structure of Spindlin1 in complex with the inhibitor VinSpinIn

Summary for 6I8B

• Entry DOI: 10.2210/pdb6i8b/pdb
• Descriptor: Spindlin-1, 2-[4-[2-[[2-[3-[2-azanyl-5-(cyclopropylmethoxy)-3,3-dimethyl-indol-6-yl]oxypropyl]-1,3-dihydroisoindol-5-yl]oxy]ethyl]-1,2,3-triazol-1-yl]-1-[4-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]ethanone, DIMETHYL SULFOXIDE, ... (6 entities in total)
• Functional Keywords: epigenetics, tudor domain, methyl-lysine, methyl-arginine, cell cycle
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 53113.25

Authors

Johansson, C.,Fagan, V.,Brennan, P.E.,Sorrell, F.J.,Krojer, T.,Arrowsmith, C.H.,Bountra, C.,Edwards, A.,Oppermann, U.C.T. (deposition date: 2018-11-19, release date: 2018-12-05, Last modification date: 2024-01-24)

• Primary citation: Fagan, V.,Johansson, C.,Gileadi, C.,Monteiro, O.,Dunford, J.E.,Nibhani, R.,Philpott, M.,Malzahn, J.,Wells, G.,Faram, R.,Cribbs, A.P.,Halidi, N.,Li, F.,Chau, I.,Greschik, H.,Velupillai, S.,Allali-Hassani, A.,Bennett, J.,Christott, T.,Giroud, C.,Lewis, A.M.,Huber, K.V.M.,Athanasou, N.,Bountra, C.,Jung, M.,Schule, R.,Vedadi, M.,Arrowsmith, C.,Xiong, Y.,Jin, J.,Fedorov, O.,Farnie, G.,Brennan, P.E.,Oppermann, U.; A Chemical Probe for Tudor Domain Protein Spindlin1 to Investigate Chromatin Function.; J.Med.Chem., 62:9008-9025, 2019; PubMed: 31550156; DOI: 10.1021/acs.jmedchem.9b00562

Experimental method

X-RAY DIFFRACTION (1.76 Å)