3DIH
Crystal structure of ammodytin L
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 298 |
| Detector technology | AREA DETECTOR |
| Collection date | 1994-08-17 |
| Detector | ENRAF-NONIUS FAST |
| Wavelength(s) | 1.5418 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 120.500, 120.500, 63.150 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 21.340 - 2.600 |
| R-factor | 0.159 |
| Rwork | 0.156 |
| R-free | 0.22600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.190 |
| RMSD bond angle | 2.000 |
| Data reduction software | MOSFLM |
| Data scaling software | rotavata/agrovata |
| Phasing software | AMoRE |
| Refinement software | MAIN |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 22.800 | 2.690 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Number of reflections | 5349 | |
| <I/σ(I)> | 7.7 | 2.8 |
| Completeness [%] | 96.9 | 94.4 |
| Redundancy | 5.8 | 5.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9 | 293 | 0.2M glycine, pH 9, 1M NaCl, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
