Target
Gag-Pol polyprotein [588-1127,Y768C]/[588-1147,Y768C]
Ligand
BDBM2666
Substrate
poly(rA)600:oligo(dT)10
Meas. Tech.
HIV-1 RT Assay
IC50
3000±n/a nM
Citation
 Romero, DLOlmsted, RAPoel, TJMorge, RABiles, CKeiser, BJKopta, LAFriis, JMHosley, JDStefanski, KJWishka, DGEvans, DBMorris, JStehle, RGSharma, SKYagi, YVoorman, RLAdams, WJTarpley, WGThomas, 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 [588-1127,Y768C]/[588-1147,Y768C]
Synonyms:
EC: 2.7.7.49 | HIV-1 Reverse Transcriptase Mutant (Y181C)
Type:
Protein Complex
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
Gag-Pol polyprotein [588-1147,Y768C]
Synonyms:
HIV-1 Reverse Transcriptase Mutant (Y181C) Chain A | POL_HV1H2 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
64426.38
Organism:
Human immunodeficiency virus type 1
Description:
P04585[588-1147,Y768C]
Residue:
560
Sequence:
PISPIETVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTKWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKKKSVTVLDVGDAYFSVPLDEDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVICQYMDDLYVGSDLEIGQHRTKIEELRQHLLRWGLTTPDKKHQKEPPFLWMGYELHPDKWTVQPIVLPEKDSWTVNDIQKLVGKLNWASQIYPGIKVRQLCKLLRGTKALTEVIPLTEEAELELAENREILKEPVHGVYYDPSKDLIAEIQKQGQGQWTYQIYQEPFKNLKTGKYARMRGAHTNDVKQLTEAVQKITTESIVIWGKTPKFKLPIQKETWETWWTEYWQATWIPEWEFVNTPPLVKLWYQLEKEPIVGAETFYVDGAANRETKLGKAGYVTNRGRQKVVTLTDTTNQKTELQAIYLALQDSGLEVNIVTDSQYALGIIQAQPDQSESELVNQIIEQLIKKEKVYLAWVPAHKGIGGNEQVDKLVSAGIRKVL
  
Component 2
Name:
Gag-Pol polyprotein [588-1127,Y768C]
Synonyms:
HIV-1 Reverse Transcriptase Mutant (Y181C) Chain B | POL_HV1H2 | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
51277.10
Organism:
Human immunodeficiency virus type 1
Description:
P04585[588-1127,Y768C]
Residue:
440
Sequence:
PISPIETVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTKWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKKKSVTVLDVGDAYFSVPLDEDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVICQYMDDLYVGSDLEIGQHRTKIEELRQHLLRWGLTTPDKKHQKEPPFLWMGYELHPDKWTVQPIVLPEKDSWTVNDIQKLVGKLNWASQIYPGIKVRQLCKLLRGTKALTEVIPLTEEAELELAENREILKEPVHGVYYDPSKDLIAEIQKQGQGQWTYQIYQEPFKNLKTGKYARMRGAHTNDVKQLTEAVQKITTESIVIWGKTPKFKLPIQKETWETWWTEYWQATWIPEWEFVNTPPLVKLWYQLEKEPIVGAETF
  
Inhibitor
Name:
BDBM2666
Synonyms:
(Alkylamino)piperidine BHAP Analog 34 | 1-[(5-Methanesulfonamidoindol-2-yl)carbonyl]-4-[N-ethyl-N-[6-chloro-3-[(1,1-dimethylethyl)amino]-2-pyridinyl]amino]piperidine | N-{2-[(4-{[3-(tert-butylamino)-6-chloropyridin-2-yl](ethyl)amino}piperidin-1-yl)carbonyl]-1H-indol-5-yl}methanesulfonamide
Type:
Small organic molecule
Emp. Form.:
C26H35ClN6O3S
Mol. Mass.:
547.113
SMILES:
CCN(C1CCN(CC1)C(=O)c1cc2cc(NS(C)(=O)=O)ccc2[nH]1)c1nc(Cl)ccc1NC(C)(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