1TLC
THYMIDYLATE SYNTHASE COMPLEXED WITH DGMP AND FOLATE ANALOG 1843U89
Experimental procedure
Detector technology | DIFFRACTOMETER |
Collection date | 1993-03-12 |
Detector | ENRAF-NONIUS FAST |
Wavelength(s) | 1.5418 |
Spacegroup name | P 63 |
Unit cell lengths | 127.140, 127.140, 67.860 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 15.000 - 2.100 |
R-factor | 0.19 * |
RMSD bond length | 0.022 |
RMSD bond angle | 0.060 |
Data reduction software | MADNES |
Refinement software | GPRLSA |
Data quality characteristics
Overall | |
High resolution limit [Å] | 2.100 * |
Rmerge | 0.086 |
Total number of observations | 120983 * |
Number of reflections | 34323 |
Completeness [%] | 94.0 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 8 * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | TS | 22 (mg/ml) | |
2 | 1 | drop | dGMP | 5 (mM) | |
3 | 1 | drop | potassium phosphate | 20 (mM) | |
4 | 1 | drop | U89 | 0.5 (mM) | |
5 | 1 | drop | dithiothreitol | 5 (mM) | |
6 | 1 | drop | ammonium sulfate | 56 (%sat) | precipitant |
7 | 1 | drop | dithiothreitol | 5 (mM) | precipitant |
8 | 1 | reservoir | ammonium sulfate | 56 (%sat) | |
9 | 1 | reservoir | dithiothreitol | 5 (mM) |