Table 1. Data-collection and refinement statistics for MAPK13/pTpY.
Data-collection statistics | |
Space group | P65 |
Unit-cell parameters () | a = 107.23, b = 107.23, c = 125.53 |
X-ray source | ALS 4.2.2 |
Wavelength () | 1.0070 |
Resolution () | 50.02.60 (2.692.60) |
R merge (%) | 0.088 (0.590) |
Completeness (%) | 97.9 (91.5) |
Multiplicity | 8.9 (5.5) |
I/(I) | 19.8 (2.0) |
Wilson B factor (2) | 48.61 |
Refinement statistics | |
R work | 0.205 (0.265) |
R free | 0.255 (0.318) |
No. of amino-acid residues | 674 |
No. of waters | 186 |
R.m.s.d., bond lengths () | 0.005 |
R.m.s.d., angles () | 1.015 |
Average B factor (2) | |
Protein (chain A/chain B) | 57.2 (51.2/63.2) |
Water | 47.8 |
Ramachandran plot | |
Favored (%) | 93.0 |
Allowed (%) | 6.1 |
Outliers (%) | 0.9 |
Poor rotamers (No./%) | 5/0.84 |
Clashscore (score/percentile) | 7.79/99th |
MolProbity score (score/percentile) | 1.87/98th |
Luzzati error | 0.3067 |
PDB code | 4myg |