3M0E
Crystal structure of the ATP-bound state of Walker B mutant of NtrC1 ATPase domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 113 |
| Detector technology | CCD |
| Collection date | 2007-05-08 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.1159 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 251.209, 242.586, 40.703 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.637 - 2.630 |
| R-factor | 0.2091 |
| Rwork | 0.205 |
| R-free | 0.24070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1NY6 (RESIDUES 140-380 OF E CHAIN OF NTRC1) |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.340 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Phasing software | MrBUMP |
| Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.637 | 2.720 |
| High resolution limit [Å] | 2.630 | 2.630 |
| Rmerge | 0.091 | 0.480 |
| Number of reflections | 75935 | |
| <I/σ(I)> | 1.8 | |
| Completeness [%] | 99.7 | 83.3 |
| Redundancy | 0.0785 | 4.78 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 277 | 0.1 M SODIUM CITRATE, 0.01 M FECL3, 0-5% (V/V) JEFFAMINE M-600, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
