4GRN
crystal structure of PAAM mutant of human MIF
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X25 |
| Synchrotron site | NSLS |
| Beamline | X25 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-12-10 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1.1 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 95.517, 95.517, 103.907 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 32.358 - 1.250 |
| R-factor | 0.1282 |
| Rwork | 0.128 |
| R-free | 0.14110 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | human MIF 1mif |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.283 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.290 |
| High resolution limit [Å] | 1.250 | 1.250 |
| Rmerge | 0.068 | 0.583 |
| Number of reflections | 150552 | |
| <I/σ(I)> | 35.71 | 3.15 |
| Completeness [%] | 99.4 | 94.3 |
| Redundancy | 17.1 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 2M NH42SO4, pH6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
