4BZP
Structure of the Mycobacterium tuberculosis APS kinase CysC in complex with ADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Collection date | 2010-06-19 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.630, 66.330, 61.760 |
| Unit cell angles | 90.00, 103.59, 90.00 |
Refinement procedure
| Resolution | 22.260 - 1.470 |
| R-factor | 0.15954 |
| Rwork | 0.158 |
| R-free | 0.18187 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2pey |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.911 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.120 | 1.550 |
| High resolution limit [Å] | 1.470 | 1.470 |
| Rmerge | 0.070 | 0.070 |
| Number of reflections | 55519 | |
| <I/σ(I)> | 9.1 | 9.1 |
| Completeness [%] | 96.0 | 96 |
| Redundancy | 2.1 | 2.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.2 M NH4NO3 24 % PEG 3,350 25 % ETHYLENE GLYCOL |
