Ligand · D06

D06 · (2S)-2-amino-1-(1,3-dihydro-2H-isoindol-2-yl)-2-[(1r,4S)-4-(pyrrolidin-1-yl)cyclohexyl]ethan-1-one

D06, (2S)-2-amino-1-(1,3-dihydro-2H-isoindol-2-yl)-2-[(1r,4S)-4-(pyrrolidin-1-yl)cyclohexyl]ethan-1-one (C20 H29 N3 O, 327.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its…

Component: D06
Formula: C20 H29 N3 O
Class: ligand
Structures: 2
PDB entries: 2

Binding sites

D06 in 2 structures; the first of them:

7SVL · DPP9 IN COMPLEX WITH LIGAND ICeD-2 · D06 A901 · binds ARG133, GLU248, GLU249, HIS500, TYR644, GLN648, VAL649, SER730 and 10 more
7SVM · DPP8 IN COMPLEX WITH LIGAND ICeD-2 · D06 A901 · binds ARG160, GLU275, GLU276, HIS525, TYR669, GLN673, VAL674, SER755 and 11 more

Residues it binds most

TYR 13, VAL 10, ARG 15, HIS 10, ALA 15, GLU 9, SER 12, LEU 9, ASN 10, GLN 9 (residue and the binding sites it lines).

Found with

TMO · trimethylamine oxide

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