3V7P
Crystal structure of amidohydrolase nis_0429 (target efi-500396) from Nitratiruptor sp. sb155-2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-11-11 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 91.515, 75.169, 75.646 |
| Unit cell angles | 90.00, 120.72, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.350 |
| R-factor | 0.12914 |
| Rwork | 0.128 |
| R-free | 0.16140 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.389 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELX |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.000 | 1.370 |
| High resolution limit [Å] | 1.350 | 1.350 |
| Rmerge | 0.730 | |
| Number of reflections | 96466 | |
| <I/σ(I)> | 9 | 1.3 |
| Completeness [%] | 99.6 | 94.3 |
| Redundancy | 4 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 0.1M MES, PH 6.0, 1M POTASSIUM SODIUM TARTRATE, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 294K |
