5DQL
Crystal Structure of 2-vinyl glyoxylate modified isocitrate lyase from Mycobacterium tuberculosis
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 | 2015-02-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 75.086, 129.236, 167.952 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 34.274 - 1.782 |
| R-factor | 0.2048 |
| Rwork | 0.203 |
| R-free | 0.24610 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1f8m |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.126 |
| Data scaling software | SCALEPACK (HKL3000) |
| Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.310 | 1.810 |
| High resolution limit [Å] | 1.780 | 1.780 |
| Rmerge | 0.200 | |
| Number of reflections | 155652 | |
| <I/σ(I)> | 14.01 | 0.45 |
| Completeness [%] | 99.6 | 97.1 |
| Redundancy | 7.7 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 290 | PEG 4000, Sodium acetate, Tris-HCl |
