Reaction Details |
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Target | Gag-Pol polyprotein [489-587] |
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Ligand | BDBM329 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_158026 (CHEMBL768619) |
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Ki | 920±n/a nM |
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Citation | Markgren, PO; Schaal, W; Hämäläinen, M; Karlén, A; Hallberg, A; Samuelsson, B; Danielson, UH Relationships between structure and interaction kinetics for HIV-1 protease inhibitors. J Med Chem45:5430-9 (2002) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Gag-Pol polyprotein [489-587] |
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Name: | Gag-Pol polyprotein [489-587] |
Synonyms: | Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol |
Type: | Enzyme Subunit |
Mol. Mass.: | 10781.16 |
Organism: | Human immunodeficiency virus type 1 |
Description: | P04585[489-587] |
Residue: | 99 |
Sequence: | PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
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BDBM329 |
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n/a |
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Name | BDBM329 |
Synonyms: | (3R,4S,5S,6R)-3,6-Bis(phenoxymethyl)-2,7-bis[4-(2-thienyl)benzyl]-4,5-dihydroxy-1,2,7-thiadiazepine 1,1-Dioxide | (3R,4S,5S,6R)-4,5-dihydroxy-3,6-bis(phenoxymethyl)-2,7-bis({[4-(thiophen-2-yl)phenyl]methyl})-1,2,7-thiadiazepane-1,1-dione | CHEMBL345997 | Cyclic Sulfamide deriv. 7 |
Type | Small organic molecule |
Emp. Form. | C40H38N2O6S3 |
Mol. Mass. | 738.935 |
SMILES | O[C@@H]1[C@@H](O)[C@@H](COc2ccccc2)N(Cc2ccc(cc2)-c2cccs2)S(=O)(=O)N(Cc2ccc(cc2)-c2cccs2)[C@@H]1COc1ccccc1 |r| |
Structure |
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