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Target
Gag-Pol polyprotein [588-1027,K690N]/[588-1147,K690N]
Ligand
BDBM5054
Substrate
Poly(rC):oligo(dG )Template:Primer
Meas. Tech.
HIV-1 RT Assay
IC50
3700±n/a nM
Citation
 Masuda, N; Yamamoto, O; Fujii, M; Ohgami, T; Fujiyasu, J; Kontani, T; Moritomo, A; Orita, M; Kurihara, H; Koga, H; Kageyama, S; Ohta, M; Inoue, H; Hatta, T; Shintani, M; Suzuki, H; Sudo, K; Shimizu, Y; Kodama, E; Matsuoka, M; Fujiwara, M; Yokota, T; Shigeta, S; Baba, M Studies of non-nucleoside HIV-1 reverse transcriptase inhibitors. Part 2: synthesis and structure-activity relationships of 2-cyano and 2-hydroxy thiazolidenebenzenesulfonamide derivatives. Bioorg Med Chem 13:949-61 (2005) [PubMed]  Article 
Target
Name:
Gag-Pol polyprotein [588-1027,K690N]/[588-1147,K690N]
Synonyms:
EC: 2.7.7.49 | HIV-1 Reverse Transcriptase Mutant (K103N)
Type:
Protein Complex
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
Gag-Pol polyprotein [588-1147,K690N]
Synonyms:
HIV-1 Reverse Transcriptase Mutant (K103N) Chain A | POL_HV1H2 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
64471.33
Organism:
Human immunodeficiency virus type 1
Description:
P04585[588-1147,K690N]
Residue:
560
Sequence:
PISPIETVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTKWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKNKSVTVLDVGDAYFSVPLDEDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVIYQYMDDLYVGSDLEIGQHRTKIEELRQHLLRWGLTTPDKKHQKEPPFLWMGYELHPDKWTVQPIVLPEKDSWTVNDIQKLVGKLNWASQIYPGIKVRQLCKLLRGTKALTEVIPLTEEAELELAENREILKEPVHGVYYDPSKDLIAEIQKQGQGQWTYQIYQEPFKNLKTGKYARMRGAHTNDVKQLTEAVQKITTESIVIWGKTPKFKLPIQKETWETWWTEYWQATWIPEWEFVNTPPLVKLWYQLEKEPIVGAETFYVDGAANRETKLGKAGYVTNRGRQKVVTLTDTTNQKTELQAIYLALQDSGLEVNIVTDSQYALGIIQAQPDQSESELVNQIIEQLIKKEKVYLAWVPAHKGIGGNEQVDKLVSAGIRKVL
  
Component 2
Name:
Gag-Pol polyprotein [588-1027,K690N]
Synonyms:
HIV-1 Reverse Transcriptase Mutant (K103N) Chain B | POL_HV1H2 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
51280.01
Organism:
Human immunodeficiency virus type 1
Description:
P04585[588-1027,K690N]
Residue:
440
Sequence:
PISPIETVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTKWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKNKSVTVLDVGDAYFSVPLDEDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFKKQNPDIVIYQYMDDLYVGSDLEIGQHRTKIEELRQHLLRWGLTTPDKKHQKEPPFLWMGYELHPDKWTVQPIVLPEKDSWTVNDIQKLVGKLNWASQIYPGIKVRQLCKLLRGTKALTEVIPLTEEAELELAENREILKEPVHGVYYDPSKDLIAEIQKQGQGQWTYQIYQEPFKNLKTGKYARMRGAHTNDVKQLTEAVQKITTESIVIWGKTPKFKLPIQKETWETWWTEYWQATWIPEWEFVNTPPLVKLWYNLEKEPIVGAETF
  
Inhibitor
Name:
BDBM5054
Synonyms:
5-Chloro-N-(4-chloro-5-isopropyl-3-methyl-1,3-thiazol-2(3H)-ylidene)-2-cyanobenzenesulfonamide | 5-chloro-N-[(2Z)-4-chloro-3-methyl-5-(propan-2-yl)-2,3-dihydro-1,3-thiazol-2-ylidene]-2-cyanobenzene-1-sulfonamide | thiazolidenebenzenesulfonamide deriv. 19
Type:
Small organic molecule
Emp. Form.:
C14H13Cl2N3O2S2
Mol. Mass.:
390.308
SMILES:
CC(C)c1s\c(=N/S(=O)(=O)c2cc(Cl)ccc2C#N)n(C)c1Cl
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
Poly(rC):oligo(dG )Template:Primer
Synonyms:
n/a
Type:
RNA /DNA Duplex
Mol. Mass.:
358.43
Organism:
n/a
Description:
The incorporation of Tritium-labeled [3H]dGTP onto a (poly)rC:(oligo)dG template:primer.
Residue:
3
Sequence:
NA