3FY1
The Acidic Mammalian Chitinase catalytic domain in complex with methylallosamidin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.1 |
| Synchrotron site | ALS |
| Beamline | 5.0.1 |
| Temperature [K] | 93 |
| Detector technology | CCD |
| Collection date | 2004-06-01 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 63.688, 89.287, 126.689 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.700 |
| R-factor | 0.17573 |
| Rwork | 0.175 |
| R-free | 0.19391 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB ID 1GUV |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.058 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.744 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.101 | |
| Number of reflections | 71824 | |
| <I/σ(I)> | 15.21 | |
| Completeness [%] | 87.6 | 89.5 |
| Redundancy | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 20% PEG 3350, 200 mM ammonium formate, 1 mM methylallosamidin, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
