5NOO
Crystal Structure of C.elegans Thymidylate Synthase in Complex with dUMP and Tomudex
Replaces: 4IQQExperimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | OXFORD DIFFRACTION NOVA |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2010-12-03 |
| Detector | AGILENT ATLAS CCD |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 70.085, 94.314, 122.048 |
| Unit cell angles | 90.00, 105.36, 90.00 |
Refinement procedure
| Resolution | 14.700 - 2.900 |
| Rwork | 0.210 |
| R-free | 0.24730 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4eb4 |
| Data reduction software | CrysalisPro (1.171.36.20) |
| Data scaling software | SCALA (3.3.20) |
| Phasing software | PHASER (2.3.0) |
| Refinement software | PHENIX (1.11.1-2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 14.700 | 3.060 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.135 | 0.375 |
| Number of reflections | 32822 | |
| <I/σ(I)> | 4.6 | |
| Completeness [%] | 96.4 | 99.1 |
| Redundancy | 1.8 | 2.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 0.1M Bis-Tris pH 7.0, 0.2M NaAcetate, 17% PEG 3350 |
