6M5X
A fungal glyceraldehyde-3-phosphate dehydrogenase with self-resistance to inhibitor heptelidic acid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-07-11 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.97930 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 76.667, 96.562, 96.699 |
| Unit cell angles | 90.00, 96.95, 90.00 |
Refinement procedure
| Resolution | 39.290 - 2.060 |
| R-factor | 0.152561571772 |
| Rwork | 0.150 |
| R-free | 0.19334 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4o59 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.999 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.100 |
| High resolution limit [Å] | 2.059 | 2.060 |
| Rmerge | 0.126 | 0.583 |
| Number of reflections | 85148 | 85148 |
| <I/σ(I)> | 2.429 | 2.429 |
| Completeness [%] | 98.6 | |
| Redundancy | 5.8 | |
| CC(1/2) | 0.837 | 0.837 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 289.15 | 0.1 M sodium acetate, 0.1M HEPES pH 7.5, 22% (w/v) PEG 4000 |
