4GLX
DNA ligase A in complex with inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 113 |
| Detector technology | CCD |
| Collection date | 2009-05-27 |
| Detector | Mar225 |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 110.990, 100.140, 86.570 |
| Unit cell angles | 90.00, 105.50, 90.00 |
Refinement procedure
| Resolution | 19.730 - 1.900 |
| R-factor | 0.2032 |
| Rwork | 0.201 |
| R-free | 0.24970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.017 |
| RMSD bond angle | 2.090 |
| Data reduction software | INTEGRATE |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 19.730 | 19.730 | 2.100 |
| High resolution limit [Å] | 1.900 | 10.000 | 1.900 |
| Rmerge | 0.159 | 0.029 | 0.649 |
| Number of reflections | 446 | 18109 | |
| <I/σ(I)> | 8.22 | 33.2 | 2.04 |
| Completeness [%] | 96.1 | 84.2 | 97.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 291.15 | 0.1 M sodium citrate, 25 mM sodium acetate, 24 % (w/v) PEG 4000, 0.2 M ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 291.15K |
