4G95
hDHFR-OAG binary complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 113 |
Detector technology | CCD |
Collection date | 2008-12-03 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.975 |
Spacegroup name | H 3 |
Unit cell lengths | 83.814, 83.814, 78.392 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 41.920 - 1.350 |
R-factor | 0.17362 |
Rwork | 0.172 |
R-free | 0.19747 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1u72 |
RMSD bond length | 0.035 |
RMSD bond angle | 2.822 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.900 | 1.420 |
High resolution limit [Å] | 1.350 | 1.350 |
Rmerge | 0.037 | 0.130 |
Number of reflections | 45098 | |
<I/σ(I)> | 32.2 | 11.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 8.5 | 5.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.9 | 287 | 100 mM K2PO4, 60-64% AS, 3% ethanol, pH 6.9, VAPOR DIFFUSION, HANGING DROP, temperature 287K |