Ligand · 8IM

8IM · 2-[2-[2-[2-[2-[2-[4-[4-[2-[7-azanyl-4-(furan-2-yl)-3,5, 6,8,10,11-hexazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2, 4,7,11-pentaen-10-yl]ethyl]piperazin-1-yl]phenoxy]ethanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]-~{N}-[5-[2,2-bis(fluoranyl)-4,6,10,12-tetramethyl-1,3-diaza-2$L^{4}-boratricyclo[7.3.0.0^{3,7}]dodeca-4,6,9, 11-tetraen-8-yl]pentyl]ethanamide

8IM, 2-[2-[2-[2-[2-[2-[4-[4-[2-[7-azanyl-4-(furan-2-yl)-3,5, 6,8,10,11-hexazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2, 4,7,11-pentaen-10-yl]ethyl]piperazin-1-yl]phenoxy]ethanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]-~{N}-[5-[2,2-bis(fluoranyl)-4,6…

Component: 8IM
Formula: C52 H68 B F2 N13 O8
Class: ligand
Structures: 1
PDB entries: 1

Binding sites

8IM in 1 structure; the first of them:

7PYR · Crystal structure of the adenosine A2A receptor (A2A-PSB1-bril) in complex with… · 8IM A2404 · binds SER67, THR68, LEU85, PHE168, GLU169, MET177, TRP246, LEU249 and 8 more

Residues it binds most

LEU 1, HIS 1, MET 1, ALA 1, ASN 1, GLU 1, ILE 1, PHE 1, SER 1, THR 1 (residue and the binding sites it lines).

Found with

CLR · Cholesterol
OLA · Oleic acid
OLC · (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate
PEG · Di(hydroxyethyl)ether

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