SDPD-SX: combining a single crystal X-ray diffraction setup with advanced powder data structure determination for use in early stage drug discovery†
Elena A.
Kabova, 
*a
Charles D.
Blundell,
b
George F. S.
Whitehead,
c
Inigo J.
Vitorica-Yrezabal,
c
Marta J.
Ross
a
and
Kenneth
Shankland
a
*a
Charles D.
Blundell,
b
George F. S.
Whitehead,
c
Inigo J.
Vitorica-Yrezabal,
c
Marta J.
Ross
a
and
Kenneth
Shankland
a
Abstract
We report a method for routine crystal structure determination on very small (typically 0.1 mg or less) amounts of crystalline material using powder X-ray diffraction data from a laboratory-based single-crystal diffractometer. The solved structures span a wide range of molecular and crystallographic complexity.
- This article is part of the themed collections: CrystEngComm up-and-coming articles and Open Access in CrystEngComm
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