Table 1. Crystallographic data collection and refinement statistics for MMP-10cd/TIMP-2 complex.
PDB ID | 4ILW |
Complexes per ASU | 2 |
Space group | P1 |
Unit cell, Å | 37.69, 56.93, 82.59 76.14°, 79.84°, 71.25° |
Resolution, Å | 2.1 |
Unique reflections | 35606 |
Completeness, % | 97.66 (94.0)a |
Multiplicity | 3.1 (2.6)a |
Mean I/(σ) | 11.2 (2.2)a |
R -merge | 0.073 (0.415)a |
Wilson B-factor, Å2 | 38.2 |
Rcryst/Rfree (%) | 0.216/0.263 |
Average B-factor, Å2 | 41.4 |
Protein atoms | 5378 |
Water molecules | 160 |
R.m.s.d. bonds, Å | 0.014 |
R.m.s.d. angles, ° | 1.667 |
Φ,Ψ angle distributionb In favored regions | 628 (93.18%) |
In allowed regions | 661 (98.07%) |
Outliers | 13 (1.93%) |
Values in parentheses are for the highest resolution shell (2.14–2.1 Å).
Ramachandran distribution is reported as defined by Molprobity/PDB validation.