4QNY
Crystal structure of MapK from Leishmania donovani, LDBPK_331470
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-04-11 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | .979183 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 56.203, 86.063, 82.066 |
| Unit cell angles | 90.00, 97.34, 90.00 |
Refinement procedure
| Resolution | 43.032 - 2.257 |
| R-factor | 0.2367 |
| Rwork | 0.234 |
| R-free | 0.28510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4b9f |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.638 |
| Data scaling software | Aimless (0.2.17) |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 46.790 | 46.790 | 2.330 |
| High resolution limit [Å] | 2.260 | 9.030 | 2.260 |
| Rmerge | 0.163 | 0.062 | 0.684 |
| Number of reflections | 35990 | ||
| <I/σ(I)> | 7 | 15.4 | 2.2 |
| Completeness [%] | 98.4 | 98 | 93.9 |
| Redundancy | 4.1 | 3.9 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 273 | 17% PEG3350, 0.2 M MgCl2, 0.1 M Tris, 5 % glycerol, 5 mM AMPPNP, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 273K |
