Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [613-1167,R896S,E946D,S1117V]/[618-1043,R896S,E946D]
Ligand
BDBM2338
Substrate
poly(rC)-oligo(dG)(12-18)
Meas. Tech.
HIV RT Assay
pH
7.8±n/a
Temperature
310.15±n/a K
IC50
>20000±n/a nM
Citation
 Artico, M; Silvestri, R; Massa, S; Loi, AG; Corrias, S; Piras, G; La Colla, P 2-Sulfonyl-4-chloroanilino moiety: a potent pharmacophore for the anti-human immunodeficiency virus type 1 activity of pyrrolyl aryl sulfones. J Med Chem 39:522-30 (1996) [PubMed]  Article 
Target
Name:
Gag-Pol polyprotein [613-1167,R896S,E946D,S1117V]/[618-1043,R896S,E946D]
Synonyms:
HIV-2 Reverse Transcriptase | HIV-2 Reverse Transcriptase RNase H
Type:
Protein Complex
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
Gag-Pol polyprotein [613-1167,R896S,E946D,S1117V]
Synonyms:
HIV-2 Reverse Transcriptase Chain A | HIV-2 Reverse Transcriptase RNase H Chain A | POL_HV2RO | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
64085.94
Organism:
Human immunodeficiency virus type 2
Description:
P04584[613-1167,R896S,E946D,S1117V]
Residue:
555
Sequence:
PVAKVEPIKIMLKPGKDGPKLRQWPLTKEKIEALKEICEKMEKEGQLEEAPPTNPYNTPTFAIKKKDKNKWRMLIDFRELNKVTQDFTEIQLGIPHPAGLAKKRRITVLDVGDAYFSIPLHEDFRPYTAFTLPSVNNAEPGKRYIYKVLPQGWKGSPAIFQHTMRQVLEPFRKANKDVIIIQYMDDILIASDRTDLEHDRVVLQLKELLNGLGFSTPDEKFQKDPPYHWMGYELWPTKWKLQKIQLPQKEIWTVNDIQKLVGVLNWAAQLYPGIKTKHLCRLISGKMTLTEEVQWTELAEAELEENRIILSQEQEGHYYQEEKELEATVQKDQDNQWTYKIHQEEKILKVGKYAKVKNTHTNGIRLLAQVVQKIGKEALVIWGRIPKFHLPVEREIWEQWWDNYWQVTWIPDWDFVSTPPLVRLAFNLVGDPIPGAETFYTDGSCNRQSKEGKAGYVTDRGKDKVKKLEQTTNQQAELEAFAMALTDSGPKVNIIVDSQYVMGIVASQPTESESKIVNQIIEEMIKKEAIYVAWVPAHKGIGGNQEVDHLVSQGI
  
Component 2
Name:
Gag-Pol polyprotein [618-1043,R896S,E946D]
Synonyms:
HIV-2 Reverse Transcriptase Chain B | HIV-2 Reverse Transcriptase RNase H Chain B | POL_HV2RO | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
50116.27
Organism:
Human immunodeficiency virus type 2
Description:
P04584[618-1043,R896S,E946D]
Residue:
426
Sequence:
EPIKIMLKPGKDGPKLRQWPLTKEKIEALKEICEKMEKEGQLEEAPPTNPYNTPTFAIKKKDKNKWRMLIDFRELNKVTQDFTEIQLGIPHPAGLAKKRRITVLDVGDAYFSIPLHEDFRPYTAFTLPSVNNAEPGKRYIYKVLPQGWKGSPAIFQHTMRQVLEPFRKANKDVIIIQYMDDILIASDRTDLEHDRVVLQLKELLNGLGFSTPDEKFQKDPPYHWMGYELWPTKWKLQKIQLPQKEIWTVNDIQKLVGVLNWAAQLYPGIKTKHLCRLISGKMTLTEEVQWTELAEAELEENRIILSQEQEGHYYQEEKELEATVQKDQDNQWTYKIHQEEKILKVGKYAKVKNTHTNGIRLLAQVVQKIGKEALVIWGRIPKFHLPVEREIWEQWWDNYWQVTWIPDWDFVSTPPLVRLAFNLVGD
  
Inhibitor
Name:
BDBM2338
Synonyms:
Methyl 1-[(2-Amino-5-chlorophenyl)sulfonyl]-1H-pyrrole-2-carboxylate | Pyrrolyl Aryl Sulfone (PAS) 8b | methyl 1-[(2-amino-5-chlorobenzene)sulfonyl]-1H-pyrrole-2-carboxylate
Type:
Small organic molecule
Emp. Form.:
C12H11ClN2O4S
Mol. Mass.:
314.745
SMILES:
COC(=O)c1cccn1S(=O)(=O)c1cc(Cl)ccc1N
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
poly(rC)-oligo(dG)(12-18)
Synonyms:
n/a
Type:
RNA/DNA duplex
Mol. Mass.:
358.43
Organism:
n/a
Description:
The incorporation of Tritium-labeled dGTP onto a poly(rC)-oligo(dG)(12-18) template-primer
Residue:
3
Sequence:
NA