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Structure paper

TitleDevelopment and characterization of novel indazole-based PPAR-gamma partial agonists
Journal, issue, pagesTo Be Published
Publish dateAug 12, 2024 (structure data deposition date)
AuthorsKoops, A.A. / Oerlemans, G.J.M. / Brunsveld, L.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.9 - 2.55 Å
Structure data

PDB-9gfu:
Human PPAR-gamma ligand binding domain in complex with AKGO172
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gvp:
Human PPAR-gamma ligand binding domain in complex with WG115
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-9gvs:
Human PPAR-gamma ligand binding domain in complex with AK176_C
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gw3:
Human PPAR-gamma ligand binding domain in complex with LW56
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-9gw4:
Human PPAR-gamma ligand binding domain in complex with LW78
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gw7:
Human PPAR-gamma ligand binding domain in complex with LW76
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gw8:
Human PPAR-gamma ligand binding domain in complex with LW75
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwb:
Human PPAR-gamma ligand binding domain in complex with LW69
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwc:
Human PPAR-gamma ligand binding domain in complex with LW99
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-9gwe:
Human PPAR-gamma ligand binding domain in complex with LW87
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gwf:
Human PPAR-gamma ligand binding domain in complex with LW100
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-9gwh:
Human PPAR-gamma ligand binding domain in complex with LW77
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gwi:
Human PPAR-gamma ligand binding domain in complex with LW23
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwk:
Human PPAR-gamma ligand binding domain in complex with AKGO6A
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwl:
Human PPAR-gamma ligand binding domain in complex with AKGO157
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwm:
Human PPAR-gamma ligand binding domain in complex with AKGO108
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwn:
Human PPAR-gamma ligand binding domain in complex with LW30
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwp:
Human PPAR-gamma ligand binding domain in complex with MRL-871 with two distinct binding modes
Method: X-RAY DIFFRACTION / Resolution: 2.55 Å

PDB-9gwq:
Human PPAR-gamma ligand binding domain in complex with AKGO6D
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gwr:
Human PPAR-gamma ligand binding domain in complex with AKGO10
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gws:
Human PPAR-gamma ligand binding domain in complex with AKGO8
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwx:
Human PPAR-gamma ligand binding domain in complex with AKGO141
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gwy:
Human PPAR-gamma ligand binding domain in complex with AKGO78
Method: X-RAY DIFFRACTION / Resolution: 2.09 Å

PDB-9gx0:
Human PPAR-gamma ligand binding domain in complex with AKGO79
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gx1:
Human PPAR-gamma ligand binding domain in complex with AKGO80
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gx2:
Human PPAR-gamma ligand binding domain in complex with AKGO82
Method: X-RAY DIFFRACTION / Resolution: 2.35 Å

PDB-9gx3:
Human PPAR-gamma ligand binding domain in complex with AKGO12
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-9gx4:
Human PPAR-gamma ligand binding domain in complex with AKGO156
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gx5:
Human PPAR-gamma ligand binding domain in complex with AKGO173
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

PDB-9gx6:
Human PPAR-gamma ligand binding domain in complex with AKGO166
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-9gx7:
Human PPAR-gamma ligand binding domain in complex with WG17
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-9gxd:
Human PPAR-gamma ligand binding domain in complex with AKGO27
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

Chemicals

PDB-1ik6:
3D structure of the E1beta subunit of pyruvate dehydrogenase from the archeon Pyrobaculum aerophilum

ChemComp-HOH:
WATER

PDB-1ipp:
HOMING ENDONUCLEASE/DNA COMPLEX

PDB-1ipr:
Unknown entry

PDB-1ipw:
INORGANIC PYROPHOSPHATASE FROM ESCHERICHIA COLI WITH THREE MAGNESIUM IONS

PDB-1ips:
ISOPENICILLIN N SYNTHASE FROM ASPERGILLUS NIDULANS (MANGANESE COMPLEX)

PDB-1ipu:
Unknown entry

PDB-1irg:
INTERFERON REGULATORY FACTOR-2 DNA BINDING DOMAIN, NMR, 20 STRUCTURES

PDB-1ipz:
Unknown entry

PDB-1ipx:
Unknown entry

PDB-1ipv:
Unknown entry

PDB-1ipt:
Unknown entry

PDB-1ip0:
NMR STRUCTURE OF HUMAN BETACELLULIN-2

PDB-1ipy:
Unknown entry

PDB-1ip9:
SOLUTION STRUCTURE OF THE PB1 DOMAIN OF BEM1P

PDB-1ip7:
G129A HUMAN LYSOZYME

PDB-1ip6:
G127A HUMAN LYSOZYME

PDB-1ip4:
G72A HUMAN LYSOZYME

ChemComp-4F1:
4-{1-[2-chloro-6-(trifluoromethyl)benzoyl]-1H-indazol-3-yl}benzoic acid

PDB-1iqa:
CRYSTAL STRUCTURE OF THE EXTRACELLULAR DOMAIN OF MOUSE RANK LIGAND

PDB-1ip3:
G68A HUMAN LYSOZYME

PDB-1iqb:
Crystal Structure of Urtica dioica Agglutinin Isolectin I

PDB-1ip8:
Unknown entry

PDB-1iqd:
Human Factor VIII C2 Domain complexed to human monoclonal BO2C11 Fab.

PDB-1iqg:
Human coagulation factor Xa in complex with M55159

PDB-1iqi:
Human coagulation factor Xa in complex with M55125

PDB-1ip5:
G105A HUMAN LYSOZYME

PDB-1iqe:
Human coagulation factor Xa in complex with M55590

PDB-1iqc:
Crystal structure of Di-Heme Peroxidase from Nitrosomonas europaea

PDB-1iqj:
Human coagulation factor Xa in complex with M55124

PDB-1iql:
Human coagulation factor Xa in complex with M54476

PDB-1iqh:
Human coagulation factor Xa in complex with M55143

PDB-1iqf:
Human coagulation factor Xa in complex with M55165

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION / PPAR / PPAR gamma / PPARg / peroxisome proliferator-activated receptor gamma / nuclear receptor / transcription factor / partial agonist / agonist

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