Ligand name: (3R,5R)-7-[1-(4-fluorophenyl)-4-(1-methylethyl)-3-{methyl[(1R)-1-phenylethyl]carbamoyl}-1H-pyrazol-5-yl]-3,5-dihydroxyheptanoic acid
PDB ligand accession: RIE
DrugBank: n/a
PubChem: 11656602
ChEMBL: CHEMBL1207355
InChI Key: MPDDTAJMJCESGV-CTUHWIOQSA-N
SMILES: CC(C)c1c(n(nc1C(=O)N(C)C(C)c2ccccc2)c3ccc(cc3)F)CCC(CC(CC(=O)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Pyrazoles

List of PDB structures and/or AlphaFold models with target protein P04035

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2R4F	Download	Experimental	e2r4fA1 e2r4fA2 e2r4fB2 e2r4fA2 e2r4fB1 e2r4fB2 e2r4fC1 e2r4fC2 e2r4fD2 e2r4fC2 e2r4fD1 e2r4fD2	Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits	LigPlot