7FQ3
DHFR:NADP+:FOL complex at 310 K (crystal 1)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-1 |
Synchrotron site | SSRL |
Beamline | BL12-1 |
Temperature [K] | 310 |
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 | 34.179, 45.486, 99.329 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 26.770 - 1.300 |
R-factor | 0.154 |
Rwork | 0.152 |
R-free | 0.18660 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 7lvc |
RMSD bond length | 0.006 |
RMSD bond angle | 1.001 |
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] | 41.360 | 1.320 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmerge | 1.594 | 8.262 |
Rpim | 0.310 | 1.596 |
Number of reflections | 73267 | 3185 |
<I/σ(I)> | 15.4 | 0.4 |
Completeness [%] | 99.4 | |
Redundancy | 26.9 | 27.1 |
CC(1/2) | 0.997 | 0.360 |
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 |