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TitleStructure-Based Discovery of Imidazo[4,5- c ]pyridine SARM1 Modulators Showing Paradoxical Activation.
Journal, issue, pagesJ. Med. Chem., Vol. 69, Page 9521-9536, Year 2026
Publish dateFeb 2, 2026 (structure data deposition date)
AuthorsAlbanese, S.K. / Hopkins, B.E. / Olland, A.M. / Fairman, A. / Shaikh, N. / Feng, S. / Thakkar, M. / Verras, A. / Dementiev, A. / Walkup 4th, W.G. ...Albanese, S.K. / Hopkins, B.E. / Olland, A.M. / Fairman, A. / Shaikh, N. / Feng, S. / Thakkar, M. / Verras, A. / Dementiev, A. / Walkup 4th, W.G. / Atsriku, C. / Srinivas, H.D. / Allen, W. / Ashraf, K. / Bos, P.H. / Hsiao, P. / Kroeck, K. / Liu, Z. / Nagarajan, A. / Szlenk, C.T. / Svensson, M. / Johnson, Z.L. / Kapilashrami, K. / Rubino, S. / Kaplan, A. / Levinson, A.M.
External linksJ. Med. Chem. / PubMed:41948869
MethodsX-ray diffraction
Resolution1.79 - 2.05 Å
Structure data

PDB-10ra:
Human SARM1 TIR domain bound to compound 6
Method: X-RAY DIFFRACTION / Resolution: 1.79 Å

PDB-10rb:
Human SARM1 TIR domain bound to compound 14
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-10rc:
Human SARM1 TIR domain bound to compound 22
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

Chemicals

PDB-1c9a:
SOLUTION STRUCTURE OF NEUROMEDIN B

ChemComp-HOH:
WATER

PDB-1c9h:
CRYSTAL STRUCTURE OF FKBP12.6 IN COMPLEX WITH RAPAMYCIN

ChemComp-GOL:
GLYCEROL

PDB-1c9i:
PEPTIDE-IN-GROOVE INTERACTIONS LINK TARGET PROTEINS TO THE B-PROPELLER OF CLATHRIN

Source
  • homo sapiens (human)
KeywordsHYDROLASE / inhibitor / adduct / NAD

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