1CMP
SMALL MOLECULE BINDING TO AN ARTIFICIALLY CREATED CAVITY AT THE ACTIVE SITE OF CYTOCHROME C PEROXIDASE
Experimental procedure
Spacegroup name | P 21 21 21 |
Unit cell lengths | 105.200, 74.300, 45.400 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 5.000 - 1.900 |
R-factor | 0.19 |
Rwork | 0.190 |
RMSD bond length | 0.015 |
RMSD bond angle | 2.800 |
Phasing software | X-PLOR |
Refinement software | X-PLOR |
Data quality characteristics
Overall | |
High resolution limit [Å] | 1.900 * |
Rmerge | 0.054 * |
Number of reflections | 22020 * |
Completeness [%] | 76.0 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, sitting drop * | 6 * | 4 * | Wang, J.M. (1990) Biochemistry, 29, 7160. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 10 (mg/ml) | |
2 | 1 | drop | potassium phosphate | 0.10 (M) | |
3 | 1 | drop | MPD | 40 (%(w/v)) | |
4 | 1 | reservoir | MPD | 30 (%(w/v)) |