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) |