1NJD
THYMIDYLATE SYNTHASE, MUTATION, N229D WITH 2'-DEOXYURIDINE 5'-MONOPHOSPHATE (DUMP)
Experimental procedure
Detector technology | IMAGE PLATE |
Collection date | 1993-04 |
Detector | RIGAKU |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 78.400, 78.400, 242.300 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 8.000 * - 2.200 |
R-factor | 0.194 |
Rwork | 0.194 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.600 * |
Data reduction software | R-AXIS |
Phasing software | X-PLOR (3.1) |
Refinement software | X-PLOR (3.1) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.200 |
Rmerge | 0.097 |
Total number of observations | 37757 * |
Number of reflections | 13487 |
Completeness [%] | 57.0 |
Redundancy | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion * | 7 * | pH 7.4 |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 3.5-6.0 (mg/ml) | |
2 | 1 | drop | dUMP | 2-20 (mM) | |
3 | 1 | drop | potassium phosphate | 40 (mM) | |
4 | 1 | drop | DTT | 1 (mM) | |
5 | 1 | drop | ammonium sulfate | 1-2 (%sat) | |
6 | 1 | reservoir | phosphate | 40 (mM) | |
7 | 1 | reservoir | DTT | ||
8 | 1 | reservoir | EDTA |