Reaction Details |
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Target | Fructose-bisphosphate aldolase |
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Ligand | BDBM96145 |
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Substrate/Competitor | n/a |
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IC50 | >1110±n/a nM |
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Citation | PubChem, PC Fluorescence-based biochemical high throughput dose response assay for inhibitors of the fructose-bisphosphate aldolase (FBA) of M. tuberculosis PubChem Bioassay(2013)[AID] |
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More Info.: | Get all data from this article |
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Fructose-bisphosphate aldolase |
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Name: | Fructose-bisphosphate aldolase |
Synonyms: | ALF_MYCTU | FBP aldolase | FBPA | Fructose-1,6-bisphosphate aldolase | Fructose-1,6-bisphosphate aldolase (FBA) | Fructose-bisphosphate aldolase | Probable fructose-bisphosphate aldolase Fba | fba |
Type: | Protein |
Mol. Mass.: | 36539.01 |
Organism: | Mycobacterium tuberculosis (strain H37Rv) |
Description: | P9WQA3 |
Residue: | 344 |
Sequence: | MPIATPEVYAEMLGQAKQNSYAFPAINCTSSETVNAAIKGFADAGSDGIIQFSTGGAEFG
SGLGVKDMVTGAVALAEFTHVIAAKYPVNVALHTDHCPKDKLDSYVRPLLAISAQRVSKG
GNPLFQSHMWDGSAVPIDENLAIAQELLKAAAAAKIILEIEIGVVGGEEDGVANEINEKL
YTSPEDFEKTIEALGAGEHGKYLLAATFGNVHGVYKPGNVKLRPDILAQGQQVAAAKLGL
PADAKPFDFVFHGGSGSLKSEIEEALRYGVVKMNVDTDTQYAFTRPIAGHMFTNYDGVLK
VDGEVGVKKVYDPRSYLKKAEASMSQRVVQACNDLHCAGKSLTH
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BDBM96145 |
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n/a |
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Name | BDBM96145 |
Synonyms: | (+)-trans-ethyl-khellactone | (9S,10R)-10-ethoxy-8,8-dimethyl-9-oxidanyl-9,10-dihydropyrano[2,3-f]chromen-2-one | (9S,10R)-10-ethoxy-9-hydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f][1]benzopyran-2-one | (9S,10R)-10-ethoxy-9-hydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f]chromen-2-one | MLS002472917 | SMR001397028 | cid_44144312 |
Type | Small organic molecule |
Emp. Form. | C16H18O5 |
Mol. Mass. | 290.3111 |
SMILES | CCO[C@H]1[C@H](O)C(C)(C)Oc2ccc3ccc(=O)oc3c12 |
Structure |
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