1JAN
COMPLEX OF PRO-LEU-GLY-HYDROXYLAMINE WITH THE CATALYTIC DOMAIN OF MATRIX METALLO PROTEINASE-8 (PHE79 FORM)
Experimental procedure
| Detector technology | IMAGE PLATE |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 33.210, 69.530, 72.540 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 8.000 - 2.500 |
| R-factor | 0.18 |
| Rwork | 0.180 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.700 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.560 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.125 | |
| Total number of observations | 20139 * | |
| Number of reflections | 5804 | |
| Completeness [%] | 93.5 * | 84.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 6 * | 22 * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 12 (mg/ml) | contained 0.0015ml protein solution |
| 10 | 1 | reservoir | potassium phosphate | 1 (M) | contained 0.006ml PEG solution |
| 11 | 1 | reservoir | 0.02 (%) | contained 0.006ml PEG solution | |
| 2 | 1 | drop | 5 (mM) | contained 0.0015ml protein solution | |
| 3 | 1 | drop | 100 (mM) | contained 0.0015ml protein solution | |
| 4 | 1 | drop | MES-NaOH | 3 (mM) | contained 0.0015ml protein solution |
| 5 | 1 | drop | 0.02 (%) | contained 0.0015ml protein solution | |
| 6 | 1 | drop | Pro-Leu-Gly-NHOH | 50 (mM) | contained 0.002ml inhibitor solution |
| 7 | 1 | drop | PEG6000 | 10 (%(m/v)) | contained 0.006ml PEG solution |
| 8 | 1 | drop | MES-NaOH | 0.2 (M) | contained 0.006ml PEG solution |
| 9 | 1 | drop | 0.02 (%) | contained 0.006ml PEG solution |
