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Target
Gag-Pol polyprotein [613-1167,R896S,E946D,S1117V]/[618-1043,R896S,E946D]
Ligand
BDBM33045
Substrate
RNA/DNA hybrid
Meas. Tech.
FRET-Based RNase H Assay
pH
8±n/a
Temperature
293.15±n/a K
IC50
2500±n/a nM
Citation
 Wendeler, M; Lee, HF; Bermingham, A; Miller, JT; Chertov, O; Bona, MK; Baichoo, NS; Ehteshami, M; Beutler, J; O'Keefe, BR; Götte, M; Kvaratskhelia, M; Le Grice, S Vinylogous ureas as a novel class of inhibitors of reverse transcriptase-associated ribonuclease H activity. ACS Chem Biol 3:635-44 (2008) [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:
BDBM33045
Synonyms:
2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide | 2-azanyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide | MLS000056922 | SMR000066289 | cid_2997881 | vinylogous urea, NSC727447
Type:
Small organic molecule
Emp. Form.:
C10H14N2OS
Mol. Mass.:
210.296
SMILES:
NC(=O)c1c(N)sc2CCCCCc12
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
RNA/DNA hybrid
Synonyms:
n/a
Type:
fluorescein-labeled RNA annealed to DNA
Mol. Mass.:
2134.40
Organism:
n/a
Description:
It is a 18-nucleotide 3-fluorescein-labeled RNA annealed to a complementary 18-nucleotide 5-Dabcyl-modified DNA.
Residue:
23
Sequence:
GACGAGCCGGGAGCFLRESCEIN