Target

Ligand

Substrate

Meas. Tech.

Protease Inhibition Assay

pH

6.2±n/a

Temperature

310.15±n/a K

Ki

0.41±n/a nM

Citation

 Boyer, FE; Vara Prasad, JV; Domagala, JM; Ellsworth, EL; Gajda, C; Hagen, SE; Markoski, LJ; Tait, BD; Lunney, EA; Palovsky, A; Ferguson, D; Graham, N; Holler, T; Hupe, D; Nouhan, C; Tummino, PJ; Urumov, A; Zeikus, E; Zeikus, G; Gracheck, SJ; Sanders, JM; VanderRoest, S; Brodfuehrer, J; Iyer, K; Sinz, M; Gulnik, SV 5,6-Dihydropyran-2-ones possessing various sulfonyl functionalities: potent nonpeptidic inhibitors of HIV protease. J Med Chem 43:843-58 (2000) [PubMed]  Article Copy BDB DOI

More Info.:

Get all data from this article,  Inhibition_Run data,   Solution Info,  Assay Method

Name:

Dimer of Gag-Pol polyprotein [489-587]

Synonyms:

HIV-1 Protease

Type:

Protein Complex

Mol. Mass.:

n/a

Description:

n/a

Components:

This complex has 2 components.

Name:

Gag-Pol polyprotein [489-587]

Synonyms:

HIV protease | HIV-1 Protease (NY5-type sequence) | HIV-1 Protease chain A | HIV-1 Protease chain B | POL_HV1N5 | gag-pol

Type:

Enzyme Subunit

Mol. Mass.:

10822.21

Organism:

Human immunodeficiency virus type 1

Description:

P12497[489-587]

Residue:

99

Sequence:

PQITLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF

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Name:

Gag-Pol polyprotein [489-587]

Synonyms:

HIV protease | HIV-1 Protease (NY5-type sequence) | HIV-1 Protease chain A | HIV-1 Protease chain B | POL_HV1N5 | gag-pol

Type:

Enzyme Subunit

Mol. Mass.:

10822.21

Organism:

Human immunodeficiency virus type 1

Description:

P12497[489-587]

Residue:

99

Sequence:

PQITLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF

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Name:

BDBM403

Synonyms:

CHEMBL169391 | Dihydropyran-2-one deriv. 8 | N-[5-tert-butyl-4-({4-hydroxy-6-[2-(4-hydroxyphenyl)ethyl]-2-oxo-6-(propan-2-yl)-5,6-dihydro-2H-pyran-3-yl}sulfanyl)-2-methylphenyl]-4-cyanobenzene-1-sulfonamide

Type:

Small organic molecule

Emp. Form.:

C34H38N2O6S2

Mol. Mass.:

634.805

SMILES:

CC(C)C1(CCc2ccc(O)cc2)CC(=O)C(Sc2cc(C)c(NS(=O)(=O)c3ccc(cc3)C#N)cc2C(C)(C)C)C(=O)O1

Structure:

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Similarity to this molecule at least:

Name:

Peptide substrate

Synonyms:

n/a

Type:

Peptide

Mol. Mass.:

3763.66

Organism:

n/a

Description:

n/a

Residue:

35

Sequence:

HISLYSALAARGVALLEPNPHEGLALANLESERNH