PDB | 6ps8 XFEL MT1R structure by ligand exchange
XFEL MT1R structure by ligand exchange from agomelatine to 2-phenylmelatonin.
label Keywords
gpcr, complex-lcp method, sbdd, drug design, xfel, lcp-sfx, ligand exchange, agomelatine, 2-phenyl melatonin, membrane protein, mt1
event_note Published
07/12/2019
blur_on Resolution
3.3 Å
filter_center_focus Method
X-RAY DIFFRACTION
add_circle Ligands
N-[2-(5-methoxy-2-phenyl-1H-indol-3-yl)ethyl]acetamide
Original publication
import_contacts Title
Toward G protein-coupled receptor structure-based drug design using X-ray lasers.
import_contacts Journal
Iucrj 2019
import_contacts DOI
10.1107/S2052252519013137
person Authors
Nakane, T., Moraes, I., Stauch, B., Joti, Y., Zatsepin, N., Li, C., Weierstall, U., Iwata, S., Han, G.W., Tono, K., Nango, E., Ishchenko, A., Cherezov, V., Tanaka, R., Gati, C., Shiriaeva, A., Batyuk, A., Liu, W.
copyrightData provided by Research Collaboration for Structural Biology, Nakane, T., Moraes, I., Stauch, B., Joti, Y., Zatsepin, N., Li, C., Weierstall, U., Iwata, S., Han, G.W., Tono, K., Nango, E., Ishchenko, A., Cherezov, V., Tanaka, R., Gati, C., Shiriaeva, A., Batyuk, A., Liu, W. , provided free of copyright via the Protein DataBank. View original data or read license terms.
