6QAL
ERK2 mini-fragment binding
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-X |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-07 |
| Detector | DECTRIS PILATUS 300K |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.864, 70.340, 60.232 |
| Unit cell angles | 90.00, 109.44, 90.00 |
Refinement procedure
| Resolution | 31.080 - 1.570 |
| R-factor | 0.18 |
| Rwork | 0.178 |
| R-free | 0.22300 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.160 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.860 | 1.610 |
| High resolution limit [Å] | 1.570 | 1.570 |
| Rmeas | 0.037 | 0.856 |
| Number of reflections | 37374 | 167 |
| <I/σ(I)> | 14.3 | |
| Completeness [%] | 70.5 | 5.6 |
| Redundancy | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293 | 0.2M (NH4)2SO4 34% MPEG 2000 0.02M Mercaptoethanol 0.1M pH=7.2 HEPES/NaOH |
