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Target
Gag-Pol polyprotein [588-1027,P823L]/[588-1147,P823L]
Ligand
BDBM1957
Substrate
poly(rA)600:oligo(dT)10
Meas. Tech.
HIV-1 RT Assay
IC50
240±n/a nM
Citation
 Romero, DL; Olmsted, RA; Poel, TJ; Morge, RA; Biles, C; Keiser, BJ; Kopta, LA; Friis, JM; Hosley, JD; Stefanski, KJ; Wishka, DG; Evans, DB; Morris, J; Stehle, RG; Sharma, SK; Yagi, Y; Voorman, RL; Adams, WJ; Tarpley, WG; Thomas, RC Targeting delavirdine/atevirdine resistant HIV-1: identification of (alkylamino)piperidine-containing bis(heteroaryl)piperazines as broad spectrum HIV-1 reverse transcriptase inhibitors. J Med Chem 39:3769-89 (1996) [PubMed]  Article 
Target
Name:
Gag-Pol polyprotein [588-1027,P823L]/[588-1147,P823L]
Synonyms:
EC: 2.7.7.49 | HIV-1 Reverse Transcriptase Mutant (P236L)
Type:
Protein Complex
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
Gag-Pol polyprotein [588-1147,P823L]
Synonyms:
HIV-1 Reverse Transcriptase Mutant (P236L) Chain A | POL_HV1H2 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
64502.45
Organism:
Human immunodeficiency virus type 1
Description:
P04585[588-1147,P823L]
Residue:
560
Sequence:
PISPIETVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTKWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKKKSVTVLDVGDAYFSVPLDEDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVIYQYMDDLYVGSDLEIGQHRTKIEELRQHLLRWGLTTPDKKHQKEPPFLWMGYELHLDKWTVQPIVLPEKDSWTVNDIQKLVGKLNWASQIYPGIKVRQLCKLLRGTKALTEVIPLTEEAELELAENREILKEPVHGVYYDPSKDLIAEIQKQGQGQWTYQIYQEPFKNLKTGKYARMRGAHTNDVKQLTEAVQKITTESIVIWGKTPKFKLPIQKETWETWWTEYWQATWIPEWEFVNTPPLVKLWYQLEKEPIVGAETFYVDGAANRETKLGKAGYVTNRGRQKVVTLTDTTNQKTELQAIYLALQDSGLEVNIVTDSQYALGIIQAQPDQSESELVNQIIEQLIKKEKVYLAWVPAHKGIGGNEQVDKLVSAGIRKVL
  
Component 2
Name:
Gag-Pol polyprotein [588-1027,P823L]
Synonyms:
HIV-1 Reverse Transcriptase Mutant (P236L) Chain B | POL_HV1H2 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
51353.17
Organism:
Human immunodeficiency virus type 1
Description:
P04585[588-1027,P823L]
Residue:
440
Sequence:
PISPIETVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTKWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKKKSVTVLDVGDAYFSVPLDEDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVIYQYMDDLYVGSDLEIGQHRTKIEELRQHLLRWGLTTPDKKHQKEPPFLWMGYELHLDKWTVQPIVLPEKDSWTVNDIQKLVGKLNWASQIYPGIKVRQLCKLLRGTKALTEVIPLTEEAELELAENREILKEPVHGVYYDPSKDLIAEIQKQGQGQWTYQIYQEPFKNLKTGKYARMRGAHTNDVKQLTEAVQKITTESIVIWGKTPKFKLPIQKETWETWWTEYWQATWIPEWEFVNTPPLVKLWYQLEKEPIVGAETF
  
Inhibitor
Name:
BDBM1957
Synonyms:
(Alkylamino)piperidine BHAP Analog 13 | 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-cyclopropyl-N-[3-[(1-methylethyl)amino]-2-pyridinyl]amino]piperidine | N-{2-[(4-{[3-(propan-2-ylamino)pyridin-2-yl](propyl)amino}piperidin-1-yl)carbonyl]-1H-indol-5-yl}methanesulfonamide
Type:
Small organic molecule
Emp. Form.:
C26H36N6O3S
Mol. Mass.:
512.667
SMILES:
CCCN(C1CCN(CC1)C(=O)c1cc2cc(NS(C)(=O)=O)ccc2[nH]1)c1ncccc1NC(C)C
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
poly(rA)600:oligo(dT)10
Synonyms:
n/a
Type:
RNA-DNA duplex
Mol. Mass.:
358.43
Organism:
n/a
Description:
The incorporation of thymidine triphosphate with [methyl-3H]thymidine 5 -triphosphate onto a poly(rA)600:oligo(dT)10 template:primer.
Residue:
3
Sequence:
NA