1XD9
Crystal Structure of the Nitrogenase Fe protein Asp39Asn with MgADP bound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 1999-12-30 |
| Detector | RIGAKU RAXIS IIC |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 57.052, 92.214, 61.375 |
| Unit cell angles | 90.00, 101.23, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.800 |
| R-factor | 0.232 |
| Rwork | 0.229 |
| R-free | 0.29900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | D39N model |
| RMSD bond length | 0.012 |
| RMSD bond angle | 2.965 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | X-PLOR |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.850 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.061 | 0.248 |
| Number of reflections | 15475 | |
| <I/σ(I)> | 15.8 | 2 |
| Completeness [%] | 95.4 | 97.2 |
| Redundancy | 7.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | SMALL TUBES | 8.5 | 298 | PEG4000, Tris HCl, sodium acetate, pH 8.5, SMALL TUBES, temperature 298K |
