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Structure paper

TitleTwo-Carbon-Elongated HIV-1 Protease Inhibitors with a Tertiary-Alcohol-Containing Transition-State Mimic.
Journal, issue, pagesJ. Med. Chem., Vol. 51, Page 1053-, Year 2008
Publish dateApr 2, 2007 (structure data deposition date)
AuthorsWu, X. / Ohrngren, P. / Ekegren, J.K. / Unge, J.T. / Unge, T.K. / Wallberg, H. / Samuelsson, B. / Hallberg, A. / Larhed, M.
External linksJ. Med. Chem. / PubMed:18215014
MethodsX-ray diffraction
Resolution1.75 - 1.76 Å
Structure data

PDB-2uxz:
Two-Carbon-Elongated HIV-1 Protease Inhibitors with a Tertiary- Alcohol-Containing Transition-State Mimic
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

PDB-2uy0:
Two-Carbon-Elongated HIV-1 Protease Inhibitors with a Tertiary- Alcohol-Containing Transition-State Mimic
Method: X-RAY DIFFRACTION / Resolution: 1.76 Å

Chemicals

ChemComp-HI1:
METHYL [(1S)-1-({2-[(4R)-4-BENZYL-4-HYDROXY-5-{[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]AMINO}-5-OXOPENTYL]-2-(4-BROMOBENZYL)HYDRAZINO}CARBONYL)-2,2-DIMETHYLPROPYL]CARBAMATE

ChemComp-HOH:
WATER

ChemComp-HV1:
METHYL [(1S)-1-({2-[(4R)-4-BENZYL-4-HYDROXY-5-{[(1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL]AMINO}-5-OXOPENTANOYL]-2-(4-BROMOBENZYL)HYDRAZINO}CARBONYL)-2,2-DIMETHYLPROPYL]CARBAMATE

Source
  • human immunodeficiency virus 1
KeywordsHYDROLASE / HIV-1 / PROTEASE / INHIBITOR / ASPARTYL PROTEASE

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