1CPS
STRUCTURAL COMPARISON OF SULFODIIMINE AND SULFONAMIDE INHIBITORS IN THEIR COMPLEXES WITH ZINC ENZYMES
Experimental procedure
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.700, 60.400, 47.200 |
| Unit cell angles | 90.00, 97.40, 90.00 |
Refinement procedure
| Resolution | 6.400 * - 2.250 |
| R-factor | 0.174 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 2.400 |
| Refinement software | PROLSQ |
Data quality characteristics
| Overall | |
| High resolution limit [Å] | 2.250 * |
| Number of reflections | 9220 * |
| Completeness [%] | 69.0 * |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Microdialysis * | 7.4 * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | 1 | CPA | ||
| 2 | 1 | 1 | 1.2 (M) | ||
| 3 | 1 | 1 | Tris-HCl | 0.02 (M) | |
| 4 | 1 | 2 | 0.15 (M) | ||
| 5 | 1 | 2 | Tris-HCl | 0.02 (M) |
