4WP9
Crystal structure of Adenylyl cyclase MA1120 from Mycobacterium Avium bound to 2'5'-DD-3'-ATP, Calcium and Magnesium ion
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-11-27 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97857 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.470, 56.090, 55.770 |
| Unit cell angles | 90.00, 110.72, 90.00 |
Refinement procedure
| Resolution | 26.949 - 1.382 |
| R-factor | 0.2326 |
| Rwork | 0.231 |
| R-free | 0.26380 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4wp8 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.177 |
| Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.050 | 1.460 |
| High resolution limit [Å] | 1.380 | 1.380 |
| Rmerge | 0.087 | 0.780 |
| Number of reflections | 61217 | |
| <I/σ(I)> | 7 | 1.6 |
| Completeness [%] | 98.7 | 97.2 |
| Redundancy | 3.6 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 9.1 | 291 | 0.2M Sodium phosphate dibasic dihydrate, 20 % w/v Polyethylene glycol 3,350 |
