Structural data | CL-K1 trimer | CL-K1 + Man 2 |
---|---|---|
PDB code | 4YLI | 4YMD |
Data collection | Â | Â |
  Beamline | Diamond I04 | Diamond I04-1 |
  Space group | P 1 21 1 | P 1 21 1 |
  a, b, c, Å | 73.0 107.6 77.8 | 71.9 106.7 78.4 |
  α, β, γ, ° | 90, 91.5, 90 | 90, 92.2, 90 |
  Resolution, Å | 48.21-2.45 (2.538-2.45) | 44.08-2.87 (2.973-2.87) |
  R sym | 0.054 (0.48) | 0.052 (0.54) |
  I/σI | 10.1 (2.0) | 11.2 (1.8) |
  Completeness, % | 95.5 (87.2) | 91.0 (93.6) |
  Redundancy | 3.3 (3.1) | 2.9 (2.9) |
Refinement | Â | Â |
  Resolution, Å | 48.21-2.45 (2.538-2.45) | 44.08-2.87 (2.973-2.87) |
  Unique reflections | 42224 (3791) | 24670 (2518) |
  R work /R free | 0.1869/0.2212 | 0.2129/0.2607 |
  No of atoms | 7332 | 7220 |
  Protein | 7162 | 7062 |
  Ligands/ion | 121 | 152 |
  water | 49 | 6 |
  B-factors, Å 2 | 74.5 | 93.2 |
  macromolecules | 74.5 | 93.0 |
  ligands | 76.4 | 105.6 |
  water | 60.7 | 62.6 |
  rms deviations |  |  |
  Bond lengths, Å | 0.003 | 0.003 |
  Bond angles, ° | 0.62 | 0.77 |