4WP8
Crystal structure of Adenylyl cyclase Ma1120 from Mycobacterium Avium in complex with 2'5'-DD-3'-ATP and Manganese 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 | 2013-09-27 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.95327 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.970, 55.960, 54.070 |
| Unit cell angles | 90.00, 106.35, 90.00 |
Refinement procedure
| Resolution | 55.960 - 1.650 |
| R-factor | 0.17401 |
| Rwork | 0.172 |
| R-free | 0.21496 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4wp3 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.279 |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.960 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.065 | 0.523 |
| Number of reflections | 35884 | |
| <I/σ(I)> | 14.3 | 3.1 |
| Completeness [%] | 99.8 | 99.5 |
| Redundancy | 11.9 | 11.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 9.1 | 291 | 0.2M Sodium phosphate dibasic dihydrate, 20 % (w/v) Polyethylene glycol 3350 |
