6HGS
Crystal Structure of Human APRT wild type in complex with GMP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-10-02 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9786 |
| Spacegroup name | P 1 |
| Unit cell lengths | 47.380, 47.680, 47.790 |
| Unit cell angles | 76.73, 69.27, 61.48 |
Refinement procedure
| Resolution | 44.570 - 1.550 |
| R-factor | 0.1584 |
| Rwork | 0.158 |
| R-free | 0.17700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6fch |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.098 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA (3.3.9) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 44.570 | 44.570 | 1.630 |
| High resolution limit [Å] | 1.550 | 4.900 | 1.550 |
| Rmerge | 0.046 | 0.031 | 0.303 |
| Rmeas | 0.059 | ||
| Rpim | 0.036 | 0.240 | 0.230 |
| Total number of observations | 3443 | 15221 | |
| Number of reflections | 47120 | ||
| <I/σ(I)> | 9.1 | 20.7 | 2.3 |
| Completeness [%] | 94.6 | 97.2 | 93.1 |
| Redundancy | 2.3 | 2.3 | 2.2 |
| CC(1/2) | 0.997 | 0.993 | 0.619 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | NaOAc, PEG4000, Glycerol, Tris |
