Ligand name: (5R,6S,9aS)-N-benzyl-6-[(4-hydroxyphenyl)methyl]-8-[(naphthalen-1-yl)methyl]-4,7-dioxohexahydro-2H-pyrazino[1,2-a]pyrimidine-1(6H)-carboxamide
PDB ligand accession: UTC
DrugBank: n/a
PubChem: 11238147
ChEMBL: CHEMBL2312139
InChI Key: HQWTUOLCGKIECB-XZWHSSHBSA-N
SMILES: c1ccc(cc1)CNC(=O)N2CCC(=O)N3C2CN(C(=O)C3Cc4ccc(cc4)O)Cc5cccc6c5cccc6
Drug action: n/a

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein Q2G036

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
8E7P Download Experimental e8e7pA1
e8e7pG1
e8e7pA1
e8e7pB1
e8e7pB1
e8e7pC1
e8e7pD1
e8e7pE1
e8e7pE1
e8e7pF1
e8e7pF1
e8e7pG1
e8e7pI1
e8e7pT1
e8e7pI1
e8e7pK1
e8e7pK1
e8e7pL1
e8e7pL1
e8e7pM1
e8e7pM1
e8e7pN1
e8e7pS1
e8e7pT1
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
ClpP/crotonase
LigPlot