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Dictionary Resources Home | Dictionary | Category Groups | Categories | Items | Data |
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Category cell 
Category Description
Data items in the CELL category record details about the
crystallographic cell parameters.
Category Examples 
Example 1:
Example 1 - based on PDB entry 5HVP and laboratory records for the
structure corresponding to PDB entry 5HVP.
_cell.entry_id '5HVP'
_cell.length_a 58.39
_cell.length_a_esd 0.05
_cell.length_b 86.70
_cell.length_b_esd 0.12
_cell.length_c 46.27
_cell.length_c_esd 0.06
_cell.angle_alpha 90.00
_cell.angle_beta 90.00
_cell.angle_gamma 90.00
_cell.volume 234237
_cell.details
; The cell parameters were refined every twenty frames during
data integration. The cell lengths given are the mean of
55 such refinements; the esds given are the root mean
square deviations of these 55 observations from that mean.
;
Example 2:
Example 2 - based on data set TOZ of Willis, Beckwith & Tozer
[Acta Cryst. (1991), C47, 2276-2277].
_cell.length_a 5.959
_cell.length_a_esd 0.001
_cell.length_b 14.956
_cell.length_b_esd 0.001
_cell.length_c 19.737
_cell.length_c_esd 0.003
_cell.angle_alpha 90.0
_cell.angle_beta 90.0
_cell.angle_gamma 90.0
_cell.volume 1759.0
_cell.volume_esd 0.3
Key Category Items 
Items in Category cell