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. Author manuscript; available in PMC: 2011 Nov 11.
Published in final edited form as: J Med Chem. 2010 Nov 11;53(21):7699–7708. doi: 10.1021/jm1008743

Table 3.

Crystallographic Data Collection and Refinement Statistics for Complexes of 17C and 18d with the Wild-Type HIV-1 Proteasea

17c 18d
Resolution (Å) 1.95 1.85
Space group P212121 P212121
a (Å) 50.67 50.79
b (Å) 57.86 58.25
c (Å) 61.91 62.01
Z 4 4
Rmerge (%) 10.2 8.7
Completeness (%) 99.7 98.4
Total no. of reflections 91018 100852
No. of unique reflections 13809 16073
Rfree (%) 20.1 22.3
Rfactor (%) 16.5 18.0
RMSDa in: 0.008 0.009
Bond lengths (Å)
RMS Angle (°) 1.340 1.317
Temperature (°C) −80 −80
PDB code 3MXD 3MXE
a

RMSD, root mean square deviation; PDB, protein data bank