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TargetGag-Pol polyprotein [489-587]
LigandBDBM50065094
Substrate/Competitorn/a
Meas. Tech.ChEMBL_157547 (CHEMBL764931)
Ki 150±n/a nM
Citation Friedman, SHGanapathi, PSRubin, YKenyon, GL Optimizing the binding of fullerene inhibitors of the HIV-1 protease through predicted increases in hydrophobic desolvation. J Med Chem41:2424-9 (1998) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Gag-Pol polyprotein [489-587]
Name:Gag-Pol polyprotein [489-587]
Synonyms:Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol
Type:Enzyme Subunit
Mol. Mass.:10781.16
Organism:Human immunodeficiency virus type 1
Description:P04585[489-587]
Residue:99
Sequence:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
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  Blast E-value cutoff:
BDBM50065094
n/a
NameBDBM50065094
Synonyms:CHEMBL440623 | [(cis,trans-3',6'-Diisopropyl-4'-hydroxy)1,2-cyclohexano]buckminsterfullerene
TypeSmall organic molecule
Emp. Form.C70H20O
Mol. Mass.876.9072
SMILESCC(C)C1CC(O)C(C(C)C)C23c4c5c6c7c8c9c(c%10c%11c2c2c4c4c%12c5c5c6c6c8c8c%13c9c9c%10c%10c%11c%11c2c2c4c4c%12c%12c5c5c6c8c6c8c%13c9c9c%10c%10c%11c2c2c4c4c%12c5c6c5c8c9c%10c2c45)C137 |(18.44,-11.99,;17.16,-11.38,;15.98,-12.19,;17.05,-9.96,;18.26,-8.98,;18.27,-7.44,;19.5,-6.74,;17.04,-6.73,;17.03,-5.3,;18.26,-4.57,;15.78,-4.59,;15.8,-7.45,;15.23,-6.52,;14.66,-7.42,;14.7,-9.2,;15.26,-10.1,;14.42,-11.56,;14.46,-11.58,;15.33,-10.17,;14.87,-9.31,;14.74,-7.54,;15.36,-6.58,;14.6,-4.94,;14.4,-5.03,;12.9,-4.55,;12.33,-5.44,;13.23,-6.89,;12.34,-8.33,;13.26,-9.76,;12.38,-11.23,;12.95,-12.1,;11.54,-12.66,;11.58,-12.69,;13.08,-12.25,;12.49,-11.51,;13.47,-9.94,;12.4,-8.4,;13.31,-7,;12.45,-5.5,;13.03,-4.36,;11.47,-3.95,;11.47,-4.03,;10.05,-4.61,;10.56,-5.47,;9.67,-6.93,;10.58,-8.35,;9.7,-9.79,;10.62,-11.24,;10.09,-12.12,;8.64,-11.6,;8.68,-11.6,;10.13,-12.15,;10.61,-11.34,;9.74,-9.85,;10.62,-8.4,;9.76,-6.92,;10.67,-5.52,;10.09,-4.61,;8.6,-5.08,;8.62,-5.18,;7.71,-6.63,;8.27,-7.49,;8.27,-9.26,;7.75,-10.18,;7.17,-9.31,;7.75,-10.21,;8.23,-9.37,;8.1,-7.49,;7.49,-6.5,;7.06,-7.54,;15.82,-9.25,)|
Structure
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