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TitleKey imidazolyl groups that induce phenylalanine flipping enhance the efficacy of oral BRD9 inhibitors for AML treatment
Journal, issue, pagesActa Pharm Sin B, Year 2025
Publish dateNov 14, 2024 (structure data deposition date)
AuthorsChen, Z. / Zhang, C. / Shen, H. / Xu, H. / Huang, Y. / Dong, R. / Tang, X. / Chai, S. / Li, J. / Xu, J. ...Chen, Z. / Zhang, C. / Shen, H. / Xu, H. / Huang, Y. / Dong, R. / Tang, X. / Chai, S. / Li, J. / Xu, J. / Zhang, X. / Zhang, Y. / Wu, X. / Xu, Y.
External linksActa Pharm Sin B / Search PubMed
MethodsX-ray diffraction
Resolution1.78 - 2.68 Å
Structure data

PDB-9kla:
Crystal Structure of the bromodomain of human BRD9 in complex with the inhibitor Y22024
Method: X-RAY DIFFRACTION / Resolution: 1.78 Å

PDB-9kly:
Crystal Structure of the bromodomain of human BRD9 in complex with the inhibitor Y22032
Method: X-RAY DIFFRACTION / Resolution: 2.15 Å

PDB-9km1:
Crystal Structure of the bromodomain of human BRD9 in complex with the inhibitor Y22077
Method: X-RAY DIFFRACTION / Resolution: 2.68 Å

Chemicals

PDB-1ef0:
CRYSTAL STRUCTURE OF PI-SCEI MINIPRECURSOR

ChemComp-GOL:
GLYCEROL

ChemComp-MLT:
D-MALATE

ChemComp-HOH:
WATER

PDB-1eha:
CRYSTAL STRUCTURE OF GLYCOSYLTREHALOSE TREHALOHYDROLASE FROM SULFOLOBUS SOLFATARICUS

PDB-1efz:
MUTAGENESIS AND CRYSTALLOGRAPHIC STUDIES OF ZYMOMONAS MOBILIS TRNA-GUANINE TRANSGLYCOSYLASE TO ELUCIDATE THE ROLE OF SERINE 103 FOR ENZYMATIC ACTIVITY

ChemComp-EDO:
1,2-ETHANEDIOL

Source
  • homo sapiens (human)
KeywordsPROTEIN BINDING / BRD9 / bromodomain / inhibitor

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