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Structure paper

TitleStructure-activity relationship and crystallographic analyses of non-secosteroidal vitamin D receptor ligands bearing diphenylsilane core as a hydrophobic pharmacophore
Journal, issue, pagesBioorg. Med. Chem., Page 118261-, Year 2025
Publish dateFeb 25, 2025 (structure data deposition date)
AuthorsMudiyanselage, H.N.T.N. / Misawa, T. / Ochiai, K. / Demizu, Y. / Hanazono, Y. / Ito, N. / Fujii, S.
External linksBioorg. Med. Chem. / Search PubMed
MethodsX-ray diffraction
Resolution1.44 - 2.18 Å
Structure data

PDB-9m10:
Vitamin D receptor complex with a dimethylbis((3-trifluoromethyl)phenyl)silane derivative
Method: X-RAY DIFFRACTION / Resolution: 2.02 Å

PDB-9m11:
Vitamin D receptor complex with a bis(3-chlorophenyl)dimethylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-9m12:
Vitamin D receptor complex with a bis(3-ethylphenyl)dimethylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.86 Å

PDB-9m13:
Vitamin D receptor complex with a dimethyldiphenylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.68 Å

PDB-9m14:
Vitamin D receptor complex with a dimethyldi(m-tolyl)silane derivative
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-9m15:
Vitamin D receptor complex with a dimethyldi(o-tolyl)silane derivative
Method: X-RAY DIFFRACTION / Resolution: 2.18 Å

PDB-9m16:
Vitamin D receptor complex with a bis(2,3-dimethylphenyl)dimethylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 2.06 Å

PDB-9m17:
Vitamin D receptor complex with a bis(3,5-dimethylphenyl)dimethylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.81 Å

PDB-9m18:
Vitamin D receptor complex with a diallyldiphenylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.96 Å

PDB-9m19:
Vitamin D receptor complex with a dibutyldiphenylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-9m1a:
Vitamin D receptor complex with a diethyldiphenylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.78 Å

PDB-9m1b:
Vitamin D receptor complex with a diphenydipropylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.77 Å

PDB-9m1c:
Vitamin D receptor complex with a triphenylpropylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.67 Å

PDB-9m1d:
Vitamin D receptor complex with a methyldiphenylpropylsilane derivative
Method: X-RAY DIFFRACTION / Resolution: 1.44 Å

Chemicals

PDB-1l7x:
Human liver glycogen phosphorylase b complexed with caffeine, N-acetyl-beta-D-glucopyranosylamine, and CP-403,700

ChemComp-HOH:
WATER

PDB-1l7y:
Solution NMR Structure of C. elegans Protein ZK652.3. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET WR41.

PDB-1l7z:
Crystal structure of Ca2+/Calmodulin complexed with myristoylated CAP-23/NAP-22 peptide

PDB-1l70:
MULTIPLE STABILIZING ALANINE REPLACEMENTS WITHIN ALPHA-HELIX 126-134 OF T4 LYSOZYME HAVE INDEPENDENT, ADDITIVE EFFECTS ON BOTH STRUCTURE AND STABILITY

PDB-1l71:
MULTIPLE STABILIZING ALANINE REPLACEMENTS WITHIN ALPHA-HELIX 126-134 OF T4 LYSOZYME HAVE INDEPENDENT, ADDITIVE EFFECTS ON BOTH STRUCTURE AND STABILITY

PDB-1l73:
MULTIPLE STABILIZING ALANINE REPLACEMENTS WITHIN ALPHA-HELIX 126-134 OF T4 LYSOZYME HAVE INDEPENDENT, ADDITIVE EFFECTS ON BOTH STRUCTURE AND STABILITY

PDB-1l74:
MULTIPLE STABILIZING ALANINE REPLACEMENTS WITHIN ALPHA-HELIX 126-134 OF T4 LYSOZYME HAVE INDEPENDENT, ADDITIVE EFFECTS ON BOTH STRUCTURE AND STABILITY

PDB-1l75:
MULTIPLE STABILIZING ALANINE REPLACEMENTS WITHIN ALPHA-HELIX 126-134 OF T4 LYSOZYME HAVE INDEPENDENT, ADDITIVE EFFECTS ON BOTH STRUCTURE AND STABILITY

PDB-1l76:
TOLERANCE OF T4 LYSOZYME TO PROLINE SUBSTITUTIONS WITHIN THE LONG INTERDOMAIN ALPHA-HELIX ILLUSTRATES THE ADAPTABILITY OF PROTEINS TO POTENTIALLY DESTABILIZING LESIONS

PDB-1l77:
DESIGN AND STRUCTURAL ANALYSIS OF ALTERNATIVE HYDROPHOBIC CORE PACKING ARRANGEMENTS IN BACTERIOPHAGE T4 LYSOZYME

PDB-1l78:
Unknown entry

PDB-1l79:
DESIGN AND STRUCTURAL ANALYSIS OF ALTERNATIVE HYDROPHOBIC CORE PACKING ARRANGEMENTS IN BACTERIOPHAGE T4 LYSOZYME

PDB-1l8a:
E. COLI PYRUVATE DEHYDROGENASE

PDB-1l8b:
Cocrystal Structure of the Messenger RNA 5' Cap-binding Protein (eIF4E) bound to 7-methylGpppG

Source
  • rattus norvegicus (Norway rat)
  • homo sapiens (human)
KeywordsTRANSCRIPTION / Vitamin D receptor

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