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Structure paper

TitleStructure-based optimization of isoaurostatin as novel PDE4 inhibitors with anti-fibrotic effects
Journal, issue, pagesChin. Chem. Lett., Page 110586-, Year 2024
Publish dateMay 31, 2024 (structure data deposition date)
AuthorsHuang, Y.Y. / Luo, X. / Zhang, K. / Liang, Y. / Zhang, F. / Liao, G. / Xie, S. / Huang, P.L. / Hou, S. / Zhou, Q. ...Huang, Y.Y. / Luo, X. / Zhang, K. / Liang, Y. / Zhang, F. / Liao, G. / Xie, S. / Huang, P.L. / Hou, S. / Zhou, Q. / Zou, Y. / Luo, H.B.
External linksChin. Chem. Lett. / Search PubMed
MethodsX-ray diffraction
Resolution2.00004554556 - 2.20000099253 Å
Structure data

PDB-8zq1:
The crystal structure of PDE4D with isoaurostatin derivatives 1-12
Method: X-RAY DIFFRACTION / Resolution: 2.20000099253 Å

PDB-8zq2:
The crystal structure of PDE4D with isoaurostatin derivatives 2-1
Method: X-RAY DIFFRACTION / Resolution: 2.10001445151 Å

PDB-8zqu:
The crystal structure of PDE4D with isoaurostatin derivatives 2-6
Method: X-RAY DIFFRACTION / Resolution: 2.00004554556 Å

PDB-8zqw:
The crystal structure of PDE4D with isoaurostatin derivatives 2-9
Method: X-RAY DIFFRACTION / Resolution: 2.10001903775 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry


PDB Unreleased entry

PDB-1d8n: CRYSTAL STRUCTURE OF THE HELICASE DOMAIN OF THE GENE 4 PROTEIN OF BACTERIOPHAGE T7: COMPLEX WITH DTDP

ChemComp-HOH:
WATER


PDB Unreleased entry

PDB-1d8o: CRYSTAL STRUCTURE OF THE HELICASE DOMAIN OF THE GENE4 PROTEIN OF BACTERIOPHAGE T7


PDB Unreleased entry

PDB-1d8p: CRYSTAL STRUCTURE OF THE HELICASE DOMAIN OF THE GENE 4 PROTEIN OF BACTERIOPHAGE T7: COMPLEX WITH DTTP


PDB Unreleased entry

PDB-1d8q: CRYSTAL STRUCTURE OF THE HELICASE DOMAIN OF THE GENE 4 PROTEIN OF BACTERIOPHAGE T7: COMPLEX WITH DATP

Source
  • homo sapiens (human)
KeywordsHYDROLASE / Inhibitor

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