1VNH
CHLOROPEROXIDASE FROM THE FUNGUS CURVULARIA INAEQUALIS: MUTANT H496A
Experimental procedure
| Temperature [K] | 287 |
| Collection date | 1998-06 |
| Spacegroup name | H 3 |
| Unit cell lengths | 131.340, 131.340, 112.660 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 8.000 - 2.110 |
| R-factor | 0.188 * |
| Rwork | 0.190 |
| R-free | 0.21900 * |
| Structure solution method | OTHER |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.620 |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 15.000 | 2.160 |
| High resolution limit [Å] | 2.110 | 2.110 |
| Rmerge | 0.087 * | 0.447 * |
| Total number of observations | 112709 * | |
| Number of reflections | 40714 | |
| <I/σ(I)> | 7 | 0.6 |
| Completeness [%] | 97.6 | 75.6 |
| Redundancy | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 7.5 * | 4 * | pH 8.0 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 5 (mg/ml) | |
| 2 | 1 | drop | MOPS | 5 (mM) | |
| 3 | 1 | drop | vanadate | 1 (mM) | |
| 4 | 1 | reservoir | ammonium sulfate | 0.85 (M) | |
| 5 | 1 | reservoir | Tris-H2SO4 | 0.05 (M) | |
| 6 | 1 | reservoir | sodium vanadate | 0.5 (mg/ml) | |
| 7 | 1 | reservoir | l-cysteine | 0.05 (M) |
