Reaction Details |
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Target | Serine/threonine-protein kinase PknB |
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Ligand | BDBM50421676 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2269370 |
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Ki | 1300±n/a nM |
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Citation | Wlodarchak, N; Feltenberger, JB; Ye, Z; Beczkiewicz, J; Procknow, R; Yan, G; King, TM; Golden, JE; Striker, R Engineering Selectivity for Reduced Toxicity of Bacterial Kinase Inhibitors Using Structure-Guided Medicinal Chemistry. ACS Med Chem Lett12:228-235 (2021) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Serine/threonine-protein kinase PknB |
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Name: | Serine/threonine-protein kinase PknB |
Synonyms: | PKNB_MYCTU | pknB |
Type: | PROTEIN |
Mol. Mass.: | 66497.93 |
Organism: | Mycobacterium tuberculosis |
Description: | ChEMBL_774233 |
Residue: | 626 |
Sequence: | MTTPSHLSDRYELGEILGFGGMSEVHLARDLRLHRDVAVKVLRADLARDPSFYLRFRREA
QNAAALNHPAIVAVYDTGEAETPAGPLPYIVMEYVDGVTLRDIVHTEGPMTPKRAIEVIA
DACQALNFSHQNGIIHRDVKPANIMISATNAVKVMDFGIARAIADSGNSVTQTAAVIGTA
QYLSPEQARGDSVDARSDVYSLGCVLYEVLTGEPPFTGDSPVSVAYQHVREDPIPPSARH
EGLSADLDAVVLKALAKNPENRYQTAAEMRADLVRVHNGEPPEAPKVLTDAERTSLLSSA
AGNLSGPRTDPLPRQDLDDTDRDRSIGSVGRWVAVVAVLAVLTVVVTIAINTFGGITRDV
QVPDVRGQSSADAIATLQNRGFKIRTLQKPDSTIPPDHVIGTDPAANTSVSAGDEITVNV
STGPEQREIPDVSTLTYAEAVKKLTAAGFGRFKQANSPSTPELVGKVIGTNPPANQTSAI
TNVVIIIVGSGPATKDIPDVAGQTVDVAQKNLNVYGFTKFSQASVDSPRPAGEVTGTNPP
AGTTVPVDSVIELQVSKGNQFVMPDLSGMFWVDAEPRLRALGWTGMLDKGADVDAGGSQH
NRVVYQNPPAGTGVNRDGIITLRFGQ
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BDBM50421676 |
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n/a |
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Name | BDBM50421676 |
Synonyms: | CHEMBL5283475 |
Type | Small organic molecule |
Emp. Form. | C22H22F3N5 |
Mol. Mass. | 413.4388 |
SMILES | CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2ccccc2)cc1C(F)(F)F |
Structure |
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