PDB | 6tot Orexin-1 receptor
Crystal structure of the Orexin-1 receptor in complex with lemborexant
label Keywords
7tm, gpcr, membrane protein
event_note Published
11/13/2024
blur_on Resolution
2.22 Å
filter_center_focus Method
X-RAY DIFFRACTION
add_circle Ligands
(1~{R},2~{S})-2-[(2,4-dimethylpyrimidin-5-yl)oxymethyl]-~{N}-(5-fluoranylpyridin-2-yl)-2-(3-fluorophenyl)cyclopropane-1-carboxamide, TETRAETHYLENE GLYCOL, SULFATE ION, octyl 1-thio-beta-D-glucopyranoside, (1R)-2-{[(S)-{[(2S)-2,3-dihydroxypropyl]oxy}(hydroxy)phosphoryl]oxy}-1-[(hexadecanoyloxy)methyl]ethyl (9Z)-octadec-9-enoate
Original publication
import_contacts Title
Comparison of Orexin 1 and Orexin 2 Ligand Binding Modes Using X-ray Crystallography and Computational Analysis.
import_contacts Journal
J.Med.Chem. 2020
import_contacts DOI
10.1021/acs.jmedchem.9b01787
person Authors
Weir, M., Cseke, G., Errey, J.C., Mason, J.S., Jazayeri, A., Dore, A.S., Congreve, M., Cooke, R.M., Rappas, M., Marshall, F.H., Bucknell, S.J., Christopher, J.A., Ali, A.A.E., Brown, J.D., de Graaf, C., Mould, R., Patel, J.C., Tehan, B.G., Bennett, K.A.
Member of
copyrightData provided by Research Collaboration for Structural Biology, Weir, M., Cseke, G., Errey, J.C., Mason, J.S., Jazayeri, A., Dore, A.S., Congreve, M., Cooke, R.M., Rappas, M., Marshall, F.H., Bucknell, S.J., Christopher, J.A., Ali, A.A.E., Brown, J.D., de Graaf, C., Mould, R., Patel, J.C., Tehan, B.G., Bennett, K.A. , provided free of copyright via the Protein DataBank. View original data or read license terms.
