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Structure paper

TitleTriphenylbutanamines: Kinesin Spindle Protein Inhibitors with in Vivo Antitumor Activity.
Journal, issue, pagesJ. Med. Chem., Vol. 55, Page 1511-, Year 2012
Publish dateOct 24, 2011 (structure data deposition date)
AuthorsWang, F. / Good, J.A.D. / Rath, O. / Kaan, H.Y.K. / Sutcliffe, O.B. / Mackay, S.P. / Kozielski, F.
External linksJ. Med. Chem. / PubMed:22248262
MethodsX-ray diffraction
Resolution2.75 Å
Structure data

PDB-4a50:
Crystal structure of human kinesin Eg5 in complex with 2-Amino-5-(3-methylphenyl)-5,5-diphenylpentanoic acid
Method: X-RAY DIFFRACTION / Resolution: 2.75 Å

PDB-4a51:
Crystal structure of human kinesin Eg5 in complex with 1-(3-(((2-Aminoethyl)thio)diphenylmethyl)phenyl)ethanone hydrochloride
Method: X-RAY DIFFRACTION / Resolution: 2.75 Å

Chemicals

ChemComp-ADP:
ADENOSINE-5'-DIPHOSPHATE / ADP, energy-carrying molecule*YM

ChemComp-MG:
Unknown entry

ChemComp-DQ6:
(2S)-2-AMINO-5-(3-METHYLPHENYL)-5,5-DIPHENYLPROPANOIC ACID

ChemComp-DQ7:
(2R)-2-AMINO-5-(3-METHYLPHENYL)-5,5-DIPHENYLPROPANOIC ACID

ChemComp-HOH:
WATER

ChemComp-DQ8:
1-(3-{[(2-aminoethyl)sulfanyl](diphenyl)methyl}phenyl)ethanone

ChemComp-CL:
Unknown entry

ChemComp-SO4:
SULFATE ION

Source
  • homo sapiens (human)
KeywordsCELL CYCLE / MITOSIS / INHIBITOR / KSP

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