Ligand · E4G

E4G · (4S)-4-[(1R)-1-hydroxy-2-({[3-(propan-2-yl) phenyl]methyl}amino)ethyl]-19-(2-oxopropoxy)-11,16-dioxa-3-azatricyclo[15.3.1.1~6,10~]docosa-1(21),6(22), 7,9,17,19-hexaen-2-one

E4G, (4S)-4-[(1R)-1-hydroxy-2-({[3-(propan-2-yl) phenyl]methyl}amino)ethyl]-19-(2-oxopropoxy)-11,16-dioxa-3-azatricyclo[15.3.1.1~6,10~]docosa-1(21),6(22), 7,9,17,19-hexaen-2-one (C34 H42 N2 O6, 574.7 g/mol), in the MolNFT structures on…

Component: E4G
Formula: C34 H42 N2 O6
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

E4G in 2 structures; the first of them:

5QCP · Crystal structure of BACE complex with BMC018 · E4G A401 · binds GLY11, GLN12, GLY13, LEU30, ASP32, GLY34, SER35, VAL69 and 17 more
5QCP · Crystal structure of bace complex with BMC018 · E4G A401 · binds GLY11, GLN12, GLY13, LEU30, ASP32, GLY34, SER35, VAL69 and 16 more

Residues it binds most

GLY 6, ILE 6, THR 6, ASP 6, GLN 6, TYR 6, ARG 6, ASN 6, LEU 6, PHE 6 (residue and the binding sites it lines).

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