5SSV
DHFR:NADP+:FOL complex at 270 K (crystal 4)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-1 |
Synchrotron site | SSRL |
Beamline | BL12-1 |
Temperature [K] | 270 |
Detector technology | PIXEL |
Collection date | 2021-11-20 |
Detector | DECTRIS EIGER2 S 16M |
Wavelength(s) | 0.826533 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 34.122, 45.264, 99.064 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 22.630 - 1.080 |
R-factor | 0.1414 |
Rwork | 0.140 |
R-free | 0.17380 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 7lvc |
RMSD bond length | 0.012 |
RMSD bond angle | 1.237 |
Data reduction software | DIALS (3.5.2) |
Data scaling software | DIALS (3.5.2) |
Phasing software | PHENIX (1.20.1_4487) |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.260 | 1.100 |
High resolution limit [Å] | 1.080 | 1.080 |
Rmerge | 0.390 | |
Rpim | 0.077 | 3.610 |
Number of reflections | 125784 | 6638 |
<I/σ(I)> | 19.7 | 0.4 |
Completeness [%] | 98.8 | |
Redundancy | 26.8 | 27.7 |
CC(1/2) | 0.999 | 0.309 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 277 | 20 mM imadazole (pH 5.4-5.8), 16-21% PEG 400, 125 mM MnCl2 |