Ligand name: Levoketoconazole
PDB ligand accession: KLN
DrugBank: DB05667
InChI Key: XMAYWYJOQHXEEK-ZEQKJWHPSA-N
SMILES: CC(=O)N1CCN(CC1)c2ccc(cc2)OCC3COC(O3)(Cn4ccnc4)c5ccc(cc5Cl)Cl
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein Q16850

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
Q16850	Download	Predicted	Q16850_F1_nD1	Cytochrome P450
3JUS		Predicted	e3jusA1 e3jusB1
3JUV		Predicted	e3juvA1
3LD6		Predicted	e3ld6A1 e3ld6B1
4UHI		Predicted	e4uhiA1 e4uhiB1 e4uhiC1 e4uhiD1
4UHL		Predicted	e4uhlA1 e4uhlB1 e4uhlC1 e4uhlD1 e4uhlE1 e4uhlF1 e4uhlG1 e4uhlH1
6Q2T		Predicted	e6q2tA1 e6q2tB1