3H0I
human Fyn SH3 domain R96I mutant, crystal form II
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2004-01-23 |
| Detector | MAR scanner 300 mm plate |
| Wavelength(s) | 1.542 |
| Spacegroup name | P 4 21 2 |
| Unit cell lengths | 90.387, 90.387, 26.770 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 23.030 - 2.200 |
| R-factor | 0.1871 |
| Rwork | 0.184 |
| R-free | 0.24323 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3h0h |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.783 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0070) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.030 | 2.320 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.122 | 0.520 |
| Number of reflections | 5956 | |
| <I/σ(I)> | 14.3 | 3.8 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 5 | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 291 | 0.2M ammonium acetate, 0.1M TRIS, 30% v/v MPD, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 291K |
