Reaction Details |
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Target | Carbonic anhydrase 13 |
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Ligand | BDBM50323341 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_643933 (CHEMBL1211832) |
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Ki | 147±n/a nM |
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Citation | Avvaru, BS; Wagner, JM; Maresca, A; Scozzafava, A; Robbins, AH; Supuran, CT; McKenna, R Carbonic anhydrase inhibitors. The X-ray crystal structure of human isoform II in adduct with an adamantyl analogue of acetazolamide resides in a less utilized binding pocket than most hydrophobic inhibitors. Bioorg Med Chem Lett20:4376-81 (2010) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Carbonic anhydrase 13 |
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Name: | Carbonic anhydrase 13 |
Synonyms: | CA13 | CAH13_HUMAN | Carbonic anhydrase | Carbonic anhydrase 13 (CA XIII) | Carbonic anhydrase XIII (CA XIII) |
Type: | Enzyme |
Mol. Mass.: | 29445.78 |
Organism: | Homo sapiens (Human) |
Description: | Q8N1Q1 |
Residue: | 262 |
Sequence: | MSRLSWGYREHNGPIHWKEFFPIADGDQQSPIEIKTKEVKYDSSLRPLSIKYDPSSAKII
SNSGHSFNVDFDDTENKSVLRGGPLTGSYRLRQVHLHWGSADDHGSEHIVDGVSYAAELH
VVHWNSDKYPSFVEAAHEPDGLAVLGVFLQIGEPNSQLQKITDTLDSIKEKGKQTRFTNF
DLLSLLPPSWDYWTYPGSLTVPPLLESVTWIVLKQPINISSQQLAKFRSLLCTAEGEAAA
FLVSNHRPPQPLKGRKVRASFH
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BDBM50323341 |
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n/a |
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Name | BDBM50323341 |
Synonyms: | CHEMBL1209039 |
Type | Small organic molecule |
Emp. Form. | C14H20N4O3S2 |
Mol. Mass. | 356.464 |
SMILES | NS(=O)(=O)c1nnc(NC(=O)CC23CC4CC(CC(C4)C2)C3)s1 |TLB:11:12:15:19.18.17,THB:13:14:17:21.12.20,13:12:15.14.19:17,20:12:15:19.18.17,20:18:15:21.13.12| |
Structure |
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