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6I12

CRYSTAL STRUCTURE OF FASCIN IN COMPLEX WITH COMPOUND 5

Summary for 6I12
Entry DOI10.2210/pdb6i12/pdb
DescriptorFascin, ACETATE ION, 2-[(4-chlorophenyl)methyl]-~{N}-(1-methylpyrazol-4-yl)-1-oxidanylidene-isoquinoline-4-carboxamide, ... (4 entities in total)
Functional Keywordsactin bundling, small molecule inhibition, structural protein
Biological sourceHomo sapiens (Human)
Total number of polymer chains1
Total formula weight55053.76
Authors
Schuettelkopf, A.W. (deposition date: 2018-10-27, release date: 2019-02-27, Last modification date: 2024-01-24)
Primary citationFrancis, S.,Croft, D.,Schuttelkopf, A.W.,Parry, C.,Pugliese, A.,Cameron, K.,Claydon, S.,Drysdale, M.,Gardner, C.,Gohlke, A.,Goodwin, G.,Gray, C.H.,Konczal, J.,McDonald, L.,Mezna, M.,Pannifer, A.,Paul, N.R.,Machesky, L.,McKinnon, H.,Bower, J.
Structure-based design, synthesis and biological evaluation of a novel series of isoquinolone and pyrazolo[4,3-c]pyridine inhibitors of fascin 1 as potential anti-metastatic agents.
Bioorg.Med.Chem.Lett., 29:1023-1029, 2019
Cited by
PubMed: 30773430
DOI: 10.1016/j.bmcl.2019.01.035
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.65 Å)
Structure validation

217705

數據於2024-03-27公開中

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