Reaction Details |
| Report a problem with these data |
Target | Isoleucine--tRNA ligase |
---|
Ligand | BDBM50524451 |
---|
Substrate/Competitor | n/a |
---|
Meas. Tech. | ChEMBL_1893379 (CHEMBL4395300) |
---|
IC50 | 6.8±n/a nM |
---|
Citation | De Ruysscher, D; Pang, L; De Graef, S; Nautiyal, M; De Borggraeve, WM; Rozenski, J; Strelkov, SV; Weeks, SD; Van Aerschot, A Acylated sulfonamide adenosines as potent inhibitors of the adenylate-forming enzyme superfamily. Eur J Med Chem174:252-264 (2019) [PubMed] Article |
---|
More Info.: | Get all data from this article, Assay Method |
---|
|
Isoleucine--tRNA ligase |
---|
Name: | Isoleucine--tRNA ligase |
Synonyms: | Isoleucine--tRNA ligase | SYI_ECOLI | ileS | ilvS | tRNA synthetase (IleRS) |
Type: | Enzyme |
Mol. Mass.: | 104286.05 |
Organism: | Escherichia coli |
Description: | n/a |
Residue: | 938 |
Sequence: | MSDYKSTLNLPETGFPMRGDLAKREPGMLARWTDDDLYGIIRAAKKGKKTFILHDGPPYA
NGSIHIGHSVNKILKDIIVKSKGLSGYDSPYVPGWDCHGLPIELKVEQEYGKPGEKFTAA
EFRAKCREYAATQVDGQRKDFIRLGVLGDWSHPYLTMDFKTEANIIRALGKIIGNGHLHK
GAKPVHWCVDCRSALAEAEVEYYDKTSPSIDVAFQAVDQDALKAKFAVSNVNGPISLVIW
TTTPWTLPANRAISIAPDFDYALVQIDGQAVILAKDLVESVMQRIGVTDYTILGTVKGAE
LELLRFTHPFMGFDVPAILGDHVTLDAGTGAVHTAPGHGPDDYVIGQKYGLETANPVGPD
GTYLPGTYPTLDGVNVFKANDIVVALLQEKGALLHVEKMQHSYPCCWRHKTPIIFRATPQ
WFVSMDQKGLRAQSLKEIKGVQWIPDWGQARIESMVANRPDWCISRQRTWGVPMSLFVHK
DTEELHPRTLELMEEVAKRVEVDGIQAWWDLDAKEILGDEADQYVKVPDTLDVWFDSGST
HSSVVDVRPEFAGHAADMYLEGSDQHRGWFMSSLMISTAMKGKAPYRQVLTHGFTVDGQG
RKMSKSIGNTVSPQDVMNKLGADILRLWVASTDYTGEMAVSDEILKRAADSYRRIRNTAR
FLLANLNGFDPAKDMVKPEEMVVLDRWAVGCAKAAQEDILKAYEAYDFHEVVQRLMRFCS
VEMGSFYLDIIKDRQYTAKADSVARRSCQTALYHIAEALVRWMAPILSFTADEVWGYLPG
EREKYVFTGEWYEGLFGLADSEAMNDAFWDELLKVRGEVNKVIEQARADKKVGGSLEAAV
TLYAEPELSAKLTALGDELRFVLLTSGATVADYNDAPADAQQSEVLKGLKVALSKAEGEK
CPRCWHYTQDVGKVAEHAEICGRCVSNVAGDGEKRKFA
|
|
|
BDBM50524451 |
---|
n/a |
---|
Name | BDBM50524451 |
Synonyms: | CHEMBL4553017 |
Type | Small organic molecule |
Emp. Form. | C17H27N7O6S |
Mol. Mass. | 457.505 |
SMILES | CC[C@H](C)[C@H](N)C(=O)NS(=O)(=O)CC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| |
Structure |
|